#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s7u s PRO 2 N 0.00 1.08 0.14 1.61 0.04 -1.26 -4.17 135.00 132.44 1s7u s PRO 2 Ca 0.00 1.29 -0.07 0.00 0.04 0.00 0.00 61.00 62.26 1s7u s PRO 2 Cb 0.00 -1.75 -0.02 0.00 0.04 0.00 0.00 34.50 32.77 1s7u s PRO 2 CO 0.00 -2.50 0.20 -1.01 0.04 0.00 0.00 177.00 173.73 1s7u s HIS 3 N -2.72 0.48 0.08 0.56 3.76 -0.66 -4.93 115.29 111.87 1s7u s HIS 3 Ca 0.65 -0.87 -0.17 0.00 -0.15 0.00 0.00 55.06 54.53 1s7u s HIS 3 Cb -0.21 -0.18 0.03 0.00 1.11 0.00 0.00 32.58 33.34 1s7u s HIS 3 CO 0.58 -0.63 0.40 -1.54 -0.85 0.00 0.00 174.74 172.70 1s7u s SER 4 N -2.97 -0.24 0.01 1.40 1.04 -1.26 -0.19 113.70 111.49 1s7u s SER 4 Ca 0.17 -0.18 0.02 0.00 0.48 0.00 0.00 55.95 56.44 1s7u s SER 4 Cb 0.05 0.44 -0.01 0.00 0.10 0.00 0.00 66.02 66.60 1s7u s SER 4 CO -0.02 -0.75 -0.08 -0.32 0.98 0.00 0.00 173.24 173.05 1s7u s MET 5 N -3.15 0.56 -0.08 4.02 1.75 -0.30 -1.10 119.30 121.00 1s7u s MET 5 Ca -0.01 -0.43 -0.07 0.00 -1.25 0.00 0.00 55.69 53.93 1s7u s MET 5 Cb 0.01 -0.49 0.03 0.00 2.84 0.00 0.00 34.83 37.21 1s7u s MET 5 CO -0.07 0.12 0.22 1.03 -0.65 0.00 0.00 175.02 175.67 1s7u s ARG 6 N -0.64 0.23 -0.14 4.11 1.81 -0.36 -1.53 118.95 122.42 1s7u s ARG 6 Ca -0.01 0.36 0.00 0.00 -1.72 0.00 0.00 55.73 54.36 1s7u s ARG 6 Cb -0.05 0.05 -0.01 0.00 -0.45 0.00 0.00 34.95 34.49 1s7u s ARG 6 CO 0.00 -0.07 -0.15 0.71 -0.68 0.00 0.00 175.30 175.11 1s7u s TYR 7 N 0.45 2.77 -0.22 -0.53 1.51 -0.05 0.02 117.35 121.29 1s7u s TYR 7 Ca -0.03 -0.88 -0.03 0.00 -1.01 0.00 0.00 57.07 55.12 1s7u s TYR 7 Cb -0.04 -1.86 0.00 0.00 -0.11 0.00 0.00 41.96 39.96 1s7u s TYR 7 CO -0.02 -0.37 -0.07 -0.06 -1.11 0.00 0.00 175.55 173.93 1s7u s PHE 8 N 0.60 2.96 0.04 2.71 0.40 -0.02 -1.54 117.98 123.13 1s7u s PHE 8 Ca -0.09 -1.18 0.09 0.00 -0.60 0.00 0.00 56.93 55.15 1s7u s PHE 8 Cb -0.16 -2.07 -0.03 0.00 0.51 0.00 0.00 43.02 41.27 1s7u s PHE 8 CO 0.03 -0.63 -0.25 -1.21 0.70 0.00 0.00 175.22 173.86 1s7u s GLU 9 N 1.42 1.68 -0.01 0.44 2.02 -0.13 -1.39 118.70 122.73 1s7u s GLU 9 Ca 0.04 -1.06 0.01 0.00 0.02 0.00 0.00 54.97 53.99 1s7u s GLU 9 Cb -0.15 -1.83 0.00 0.00 0.10 0.00 0.00 34.13 32.25 1s7u s GLU 9 CO -0.05 0.47 -0.03 0.99 0.02 0.00 0.00 175.26 176.66 1s7u s THR 10 N -0.80 0.29 -0.08 3.63 2.01 0.15 -0.86 115.64 119.99 1s7u s THR 10 Ca 0.10 -0.13 0.02 0.00 0.31 0.00 0.00 61.69 62.00 1s7u s THR 10 Cb -0.10 -0.27 0.01 0.00 0.01 0.00 0.00 72.50 72.16 1s7u s THR 10 CO 0.02 0.10 -0.14 0.00 -0.69 0.00 0.00 174.62 173.91 1s7u s ALA 11 N 0.09 1.43 -0.10 7.40 0.00 -0.40 -0.79 121.76 129.39 1s7u s ALA 11 Ca -0.01 -0.53 0.01 0.00 0.00 0.00 0.00 51.96 51.44 1s7u s ALA 11 Cb -0.04 -0.66 0.02 0.00 0.00 0.00 0.00 23.12 22.45 1s7u s ALA 11 CO -0.00 0.07 -0.13 0.14 0.00 0.00 0.00 175.76 175.84 1s7u s VAL 12 N 0.75 1.33 -0.02 0.00 -7.23 -0.45 -1.50 120.40 113.27 1s7u s VAL 12 Ca -0.13 -0.53 -0.02 0.00 -1.81 0.00 0.00 61.98 59.49 1s7u s VAL 12 Cb -0.16 -1.24 -0.04 0.00 0.56 0.00 0.00 36.38 35.50 1s7u s VAL 12 CO 0.03 0.41 0.12 -0.94 -0.31 0.00 0.00 175.10 174.40 1s7u s SER 13 N 1.11 5.96 0.07 4.85 1.04 -0.31 -1.37 113.70 125.05 1s7u s SER 13 Ca -0.05 0.25 0.03 0.00 0.48 0.00 0.00 55.95 56.66 1s7u s SER 13 Cb -0.14 -1.79 -0.03 0.00 0.10 0.00 0.00 66.02 64.16 1s7u s SER 13 CO -0.03 0.29 -0.09 -0.13 0.98 0.00 0.00 173.24 174.26 1s7u s ARG 14 N -1.68 0.69 0.21 4.02 0.52 -1.26 -2.13 118.95 119.32 1s7u s ARG 14 Ca 0.23 -0.96 -0.30 0.00 -0.52 0.00 0.00 55.73 54.18 1s7u s ARG 14 Cb -0.12 -0.43 -0.09 0.00 0.52 0.00 0.00 34.95 34.83 1s7u s ARG 14 CO 0.14 0.07 1.27 -1.25 0.02 0.00 0.00 175.30 175.55 1s7u s PRO 15 N -2.18 4.43 0.00 3.54 0.04 -1.23 -2.34 135.00 137.26 1s7u s PRO 15 Ca -0.02 2.01 0.00 0.00 0.04 0.00 0.00 61.00 63.02 1s7u s PRO 15 Cb -0.06 -3.19 0.00 0.00 0.04 0.00 0.00 34.50 31.28 1s7u s PRO 15 CO -0.00 -0.18 0.00 0.41 0.04 0.00 0.00 177.00 177.27 1s7u n GLY 16 N 2.10 0.92 3.71 0.56 0.00 -1.26 -5.02 105.19 106.19 1s7u n GLY 16 Ca 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 1s7u n GLY 16 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1s7u s LEU 17 N 0.00 3.72 -0.04 0.99 2.01 -0.99 -5.06 118.68 119.32 1s7u s LEU 17 Ca 0.00 0.19 -0.04 0.00 0.01 0.00 0.00 54.13 54.29 1s7u s LEU 17 Cb 0.00 -1.87 -0.02 0.00 0.01 0.00 0.00 46.19 44.31 1s7u s LEU 17 CO 0.00 0.36 0.23 -0.33 1.01 0.00 0.00 176.35 177.62 1s7u h GLU 18 N 5.28 -0.12 -5.98 1.70 5.08 -1.96 -3.43 114.58 115.14 1s7u h GLU 18 Ca -0.50 0.01 -0.63 0.00 -1.00 0.00 0.00 59.36 57.24 1s7u h GLU 18 Cb 1.20 0.03 -0.06 0.00 0.50 0.00 0.00 28.75 30.42 1s7u h GLU 18 CO 0.56 -0.08 -0.53 -1.21 -1.00 0.00 0.00 179.01 176.75 1s7u s GLU 19 N -1.87 3.26 0.66 2.33 0.41 -1.26 -5.01 118.70 117.22 1s7u s GLU 19 Ca -0.02 -0.50 -0.15 0.00 -0.41 0.00 0.00 54.97 53.89 1s7u s GLU 19 Cb 0.00 -2.95 0.00 0.00 -1.78 0.00 0.00 34.13 29.41 1s7u s GLU 19 CO 0.06 0.61 1.12 -1.25 -0.49 0.00 0.00 175.26 175.31 1s7u s PRO 20 N -2.36 2.73 0.05 0.39 0.04 -1.26 -4.87 135.00 129.73 1s7u s PRO 20 Ca 0.32 1.44 -0.21 0.00 0.04 0.00 0.00 61.00 62.59 1s7u s PRO 20 Cb -0.13 -1.94 -0.06 0.00 0.04 0.00 0.00 34.50 32.41 1s7u s PRO 20 CO 0.24 -1.31 0.63 0.50 0.04 0.00 0.00 177.00 177.10 1s7u s ARG 21 N -4.05 4.33 -0.14 4.56 3.52 -0.47 -4.87 118.95 121.83 1s7u s ARG 21 Ca 0.68 0.83 0.02 0.00 -0.13 0.00 0.00 55.73 57.13 1s7u s ARG 21 Cb -0.22 -3.29 0.01 0.00 -1.56 0.00 0.00 34.95 29.89 1s7u s ARG 21 CO 0.41 0.49 -0.22 -0.47 -0.81 0.00 0.00 175.30 174.71 1s7u s TYR 22 N -0.65 2.68 -0.06 5.12 5.04 -1.26 -1.34 117.35 126.87 1s7u s TYR 22 Ca 0.32 -1.36 0.04 0.00 -2.44 0.00 0.00 57.07 53.63 1s7u s TYR 22 Cb -0.20 -1.82 -0.00 0.00 0.35 0.00 0.00 41.96 40.29 1s7u s TYR 22 CO 0.20 -0.62 -0.19 0.42 -1.34 0.00 0.00 175.55 174.02 1s7u s ILE 23 N 0.84 1.57 -0.05 3.14 1.01 0.03 -1.55 121.20 126.20 1s7u s ILE 23 Ca -0.06 -0.78 0.05 0.00 0.00 0.00 0.00 60.65 59.85 1s7u s ILE 23 Cb -0.15 -1.36 -0.00 0.00 0.01 0.00 0.00 42.46 40.95 1s7u s ILE 23 CO -0.02 0.45 -0.19 -0.55 0.00 0.00 0.00 174.94 174.63 1s7u s SER 24 N 0.14 2.34 -0.08 3.58 0.15 -0.05 -0.67 113.70 119.10 1s7u s SER 24 Ca -0.07 -0.39 0.01 0.00 0.70 0.00 0.00 55.95 56.20 1s7u s SER 24 Cb -0.13 -0.67 0.02 0.00 -1.71 0.00 0.00 66.02 63.53 1s7u s SER 24 CO 0.04 0.17 -0.08 -0.69 1.20 0.00 0.00 173.24 173.87 1s7u s VAL 25 N 0.02 0.96 -0.03 4.45 1.01 -0.48 -0.92 120.40 125.41 1s7u s VAL 25 Ca -0.04 -0.31 -0.03 0.00 0.00 0.00 0.00 61.98 61.59 1s7u s VAL 25 Cb -0.12 -0.94 -0.04 0.00 0.00 0.00 0.00 36.38 35.28 1s7u s VAL 25 CO 0.03 0.33 0.14 -0.83 0.00 0.00 0.00 175.10 174.77 1s7u s GLY 26 N 1.19 2.12 0.00 4.51 0.00 -0.70 -0.84 107.32 113.60 1s7u s GLY 26 Ca -0.05 -0.77 0.03 0.00 0.00 0.00 0.00 44.72 43.92 1s7u s GLY 26 CO -0.02 -0.63 -0.10 -0.19 0.00 0.00 0.00 173.10 172.16 1s7u s TYR 27 N -1.22 0.88 -0.12 1.90 1.51 0.10 -1.10 117.35 119.29 1s7u s TYR 27 Ca 0.23 -0.20 0.03 0.00 -1.01 0.00 0.00 57.07 56.12 1s7u s TYR 27 Cb -0.12 -0.55 0.01 0.00 -0.11 0.00 0.00 41.96 41.18 1s7u s TYR 27 CO 0.14 -0.01 -0.21 0.08 -1.11 0.00 0.00 175.55 174.44 1s7u s VAL 28 N -0.37 1.91 -1.24 0.71 1.01 -0.52 -1.23 120.40 120.68 1s7u s VAL 28 Ca 0.03 -0.90 -0.10 0.00 0.00 0.00 0.00 61.98 61.00 1s7u s VAL 28 Cb -0.05 -1.69 -0.01 0.00 0.00 0.00 0.00 36.38 34.63 1s7u s VAL 28 CO -0.00 0.52 0.69 0.47 0.00 0.00 0.00 175.10 176.78 1s7u n ASP 29 N 3.98 -3.16 -2.55 3.32 8.00 -0.26 -2.48 116.55 123.41 1s7u n ASP 29 Ca -0.20 -0.95 -0.14 0.00 0.71 0.00 0.00 54.79 54.21 1s7u n ASP 29 Cb 0.52 -3.57 -0.00 0.00 -0.02 0.00 0.00 41.12 38.05 1s7u n ASP 29 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1s7u n ASN 30 N -2.87 -4.10 -3.88 -2.24 3.02 -1.26 -4.96 115.26 98.96 1s7u n ASN 30 Ca -0.20 0.11 -0.18 0.00 -0.03 0.00 0.00 54.58 54.28 1s7u n ASN 30 Cb 0.64 -3.46 -0.16 0.00 -0.61 0.00 0.00 39.78 36.19 1s7u n ASN 30 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1s7u s LYS 31 N -5.15 0.55 0.16 3.52 1.02 -1.03 -5.09 119.74 113.71 1s7u s LYS 31 Ca 0.05 -0.06 -0.32 0.00 0.02 0.00 0.00 55.97 55.67 1s7u s LYS 31 Cb -0.03 -0.61 -0.10 0.00 -0.52 0.00 0.00 37.83 36.58 1s7u s LYS 31 CO 0.06 -0.06 1.55 -2.00 -0.92 0.00 0.00 175.35 173.98 1s7u s GLU 32 N 0.71 4.23 0.00 1.68 2.12 -1.26 -1.43 118.70 124.74 1s7u s GLU 32 Ca -0.08 2.33 0.00 0.00 0.36 0.00 0.00 54.97 57.57 1s7u s GLU 32 Cb -0.11 -3.17 0.00 0.00 0.26 0.00 0.00 34.13 31.10 1s7u s GLU 32 CO -0.01 -0.59 0.00 1.97 -0.54 0.00 0.00 175.26 176.10 1s7u n PHE 33 N 3.99 0.00 -4.05 5.30 -1.74 -0.26 -4.16 117.46 116.53 1s7u n PHE 33 Ca 0.14 0.00 -0.07 0.00 -0.56 0.00 0.00 57.45 56.95 1s7u n PHE 33 Cb 0.39 0.00 -0.09 0.00 1.52 0.00 0.00 39.48 41.29 1s7u n PHE 33 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 1s7u s VAL 34 N -1.14 0.20 -0.26 1.97 -7.23 -1.21 -1.39 120.40 111.34 1s7u s VAL 34 Ca 0.00 -1.70 -0.24 0.00 -1.81 0.00 0.00 61.98 58.23 1s7u s VAL 34 Cb 0.00 -1.52 0.07 0.00 0.56 0.00 0.00 36.38 35.49 1s7u s VAL 34 CO 0.00 -0.90 0.70 -0.60 -0.31 0.00 0.00 175.10 173.99 1s7u s ARG 35 N -3.92 0.81 -0.01 4.82 3.52 -0.81 -1.72 118.95 121.65 1s7u s ARG 35 Ca 0.08 0.99 0.02 0.00 -0.13 0.00 0.00 55.73 56.69 1s7u s ARG 35 Cb 0.07 0.38 -0.00 0.00 -1.56 0.00 0.00 34.95 33.84 1s7u s ARG 35 CO -0.09 -0.10 -0.08 0.12 -0.81 0.00 0.00 175.30 174.34 1s7u s PHE 36 N 0.45 0.73 -0.18 5.12 2.19 -0.10 -1.44 117.98 124.76 1s7u s PHE 36 Ca -0.01 -0.15 -0.04 0.00 0.33 0.00 0.00 56.93 57.06 1s7u s PHE 36 Cb -0.05 -0.50 0.09 0.00 -1.31 0.00 0.00 43.02 41.25 1s7u s PHE 36 CO -0.00 -0.04 0.30 0.34 1.83 0.00 0.00 175.22 177.64 1s7u s ASP 37 N -0.02 0.47 0.21 6.13 -1.08 -1.26 -0.88 116.67 120.25 1s7u s ASP 37 Ca 0.01 0.39 0.20 0.00 -0.52 0.00 0.00 52.55 52.63 1s7u s ASP 37 Cb -0.05 0.80 0.89 0.00 -1.46 0.00 0.00 42.92 43.10 1s7u s ASP 37 CO -0.00 -0.27 1.61 -1.54 0.52 0.00 0.00 175.17 175.49 1s7u n SER 38 N 5.35 0.49 0.11 -0.34 3.41 -0.59 -2.62 113.62 119.42 1s7u n SER 38 Ca -0.06 0.65 0.02 0.00 -0.26 0.00 0.00 58.87 59.22 1s7u n SER 38 Cb 0.50 -0.74 -0.01 0.00 -0.26 0.00 0.00 64.21 63.70 1s7u n SER 38 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1s7u h ASP 39 N 0.00 0.00 -3.10 4.04 5.19 -1.96 -3.46 116.42 117.12 1s7u h ASP 39 Ca 0.00 0.00 -0.58 0.00 -0.62 0.00 0.00 57.03 55.83 1s7u h ASP 39 Cb 0.25 0.00 0.17 0.00 0.18 0.00 0.00 39.33 39.93 1s7u h ASP 39 CO 0.00 0.49 -0.29 0.00 -3.12 0.00 0.00 179.24 176.31 1s7u n ALA 40 N -2.27 -0.91 -0.36 3.45 0.00 -1.08 -4.89 120.51 114.46 1s7u n ALA 40 Ca -0.02 -0.03 0.02 0.00 0.00 0.00 0.00 53.44 53.41 1s7u n ALA 40 Cb 0.75 -1.88 0.17 0.00 0.00 0.00 0.00 19.45 18.49 1s7u n ALA 40 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1s7u h GLU 41 N 0.24 1.10 -2.53 0.00 4.81 -1.90 -3.29 114.58 113.01 1s7u h GLU 41 Ca -0.46 -0.07 -0.60 0.00 -0.13 0.00 0.00 59.36 58.10 1s7u h GLU 41 Cb 1.39 -0.25 -0.42 0.00 0.63 0.00 0.00 28.75 30.11 1s7u h GLU 41 CO 0.47 0.73 -0.64 -1.71 -0.73 0.00 0.00 179.01 177.13 1s7u n ASN 42 N -4.53 3.03 -4.57 1.04 5.15 -1.26 -5.07 115.26 109.05 1s7u n ASN 42 Ca 0.15 -3.25 -0.50 0.00 -0.60 0.00 0.00 54.58 50.38 1s7u n ASN 42 Cb 0.18 -0.70 -0.06 0.00 -0.53 0.00 0.00 39.78 38.68 1s7u n ASN 42 CO 0.00 0.00 0.00 -2.65 1.40 0.00 0.00 177.26 176.01 1s7u n PRO 43 N 1.40 1.56 -3.75 1.20 -0.02 -1.24 -4.92 135.00 129.23 1s7u n PRO 43 Ca 0.26 0.50 -0.13 0.00 -2.02 0.00 0.00 63.50 62.10 1s7u n PRO 43 Cb 0.40 -2.60 -0.08 0.00 -0.02 0.00 0.00 33.50 31.20 1s7u n PRO 43 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1s7u s ARG 44 N 5.31 0.72 0.29 -0.52 0.52 -1.26 -5.01 118.95 118.99 1s7u s ARG 44 Ca 1.02 -0.25 -0.29 0.00 -0.52 0.00 0.00 55.73 55.68 1s7u s ARG 44 Cb -0.75 0.32 -0.10 0.00 0.52 0.00 0.00 34.95 34.94 1s7u s ARG 44 CO 0.50 -0.21 1.36 0.71 0.02 0.00 0.00 175.30 177.68 1s7u s TYR 45 N -1.63 3.04 0.02 -0.53 2.02 -1.25 -4.28 117.35 114.74 1s7u s TYR 45 Ca -0.11 1.24 -0.01 0.00 -0.37 0.00 0.00 57.07 57.82 1s7u s TYR 45 Cb -0.04 -3.74 -0.02 0.00 -0.40 0.00 0.00 41.96 37.77 1s7u s TYR 45 CO 0.03 -2.20 -0.01 -1.21 -1.57 0.00 0.00 175.55 170.59 1s7u s GLU 46 N -1.08 0.38 0.49 -0.62 0.41 -0.52 -4.94 118.70 112.81 1s7u s GLU 46 Ca 0.54 -0.68 -0.22 0.00 -0.41 0.00 0.00 54.97 54.20 1s7u s GLU 46 Cb -0.40 0.14 -0.07 0.00 -1.78 0.00 0.00 34.13 32.02 1s7u s GLU 46 CO 0.48 -0.07 1.15 -1.25 -0.49 0.00 0.00 175.26 175.08 1s7u s PRO 47 N -1.83 3.63 0.00 0.39 0.04 -1.26 -1.92 135.00 134.05 1s7u s PRO 47 Ca -0.12 1.72 0.00 0.00 0.04 0.00 0.00 61.00 62.63 1s7u s PRO 47 Cb -0.07 -2.27 0.00 0.00 0.04 0.00 0.00 34.50 32.20 1s7u s PRO 47 CO -0.02 -0.65 0.21 0.54 0.04 0.00 0.00 177.00 177.12 1s7u n ARG 48 N -0.76 1.65 -4.26 4.56 5.12 -0.49 -4.87 116.66 117.62 1s7u n ARG 48 Ca 0.09 -0.21 -0.21 0.00 -1.93 0.00 0.00 57.85 55.58 1s7u n ARG 48 Cb 0.49 -0.65 -0.12 0.00 -1.16 0.00 0.00 32.46 31.02 1s7u n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1s7u s ALA 49 N -0.30 1.67 0.24 7.54 0.00 -1.25 -4.76 121.76 124.91 1s7u s ALA 49 Ca 0.00 -1.25 -0.05 0.00 0.00 0.00 0.00 51.96 50.66 1s7u s ALA 49 Cb 0.00 -0.18 0.45 0.00 0.00 0.00 0.00 23.12 23.39 1s7u s ALA 49 CO 0.00 0.26 1.70 -1.35 0.00 0.00 0.00 175.76 176.37 1s7u h PRO 50 N 3.88 0.31 0.00 0.00 0.11 -1.96 -2.81 132.00 131.53 1s7u h PRO 50 Ca -0.43 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.63 1s7u h PRO 50 Cb 1.19 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 1s7u h PRO 50 CO 0.43 0.21 -0.12 0.11 -0.21 0.00 0.00 178.00 178.43 1s7u h TRP 51 N 0.32 0.00 0.00 0.65 5.08 -1.97 -2.76 115.95 117.27 1s7u h TRP 51 Ca 0.41 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.38 1s7u h TRP 51 Cb 0.66 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.82 1s7u h TRP 51 CO -0.23 0.12 0.00 -1.33 -1.28 0.00 0.00 178.44 175.72 1s7u n MET 52 N -3.52 0.04 0.02 0.12 2.81 -1.06 -3.26 117.12 112.27 1s7u n MET 52 Ca -0.01 0.17 0.09 0.00 -1.81 0.00 0.00 57.70 56.14 1s7u n MET 52 Cb 0.26 -1.55 0.40 0.00 -0.71 0.00 0.00 33.22 31.61 1s7u n MET 52 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1s7u n GLU 53 N -1.62 0.04 0.13 0.03 1.02 -1.04 -2.52 120.64 116.68 1s7u n GLU 53 Ca 0.05 0.23 0.06 0.00 -0.02 0.00 0.00 57.16 57.47 1s7u n GLU 53 Cb 0.26 -1.57 0.51 0.00 -0.02 0.00 0.00 31.44 30.63 1s7u n GLU 53 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 1s7u h GLN 54 N 0.00 0.27 -6.98 3.49 4.20 -1.79 -3.44 115.11 110.86 1s7u h GLN 54 Ca 0.00 -0.02 -0.53 0.00 0.06 0.00 0.00 58.65 58.16 1s7u h GLN 54 Cb 0.34 -0.06 0.10 0.00 0.30 0.00 0.00 27.48 28.16 1s7u h GLN 54 CO 0.00 0.21 0.63 -1.21 -0.67 0.00 0.00 178.83 177.79 1s7u s GLU 55 N -5.22 3.76 0.84 1.46 0.41 -1.05 -5.01 118.70 113.89 1s7u s GLU 55 Ca -0.07 2.22 -0.09 0.00 -0.41 0.00 0.00 54.97 56.62 1s7u s GLU 55 Cb 0.17 -2.64 0.16 0.00 -1.78 0.00 0.00 34.13 30.04 1s7u s GLU 55 CO 0.70 -0.69 1.17 0.20 -0.49 0.00 0.00 175.26 176.16 1s7u s GLY 56 N -0.73 1.76 0.49 -1.39 0.00 -1.26 -4.95 107.32 101.24 1s7u s GLY 56 Ca 0.60 -1.37 0.16 0.00 0.00 0.00 0.00 44.72 44.12 1s7u s GLY 56 CO 0.50 -0.71 2.09 -0.56 0.00 0.00 0.00 173.10 174.42 1s7u h PRO 57 N -1.12 0.00 -0.61 2.90 0.13 -1.98 -2.46 132.00 128.85 1s7u h PRO 57 Ca -0.41 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.66 1s7u h PRO 57 Cb 1.26 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.36 1s7u h PRO 57 CO 0.41 0.07 0.14 1.49 -0.23 0.00 0.00 178.00 179.89 1s7u h GLU 58 N 0.00 0.97 0.29 0.86 4.81 -1.99 -1.42 114.58 118.10 1s7u h GLU 58 Ca -0.00 -0.22 -0.01 0.00 -0.13 0.00 0.00 59.36 59.00 1s7u h GLU 58 Cb 0.13 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1s7u h GLU 58 CO 0.01 0.87 -0.15 -0.92 -0.73 0.00 0.00 179.01 178.08 1s7u h TYR 59 N 0.92 -0.40 -0.12 0.92 3.20 -1.81 -1.93 116.97 117.75 1s7u h TYR 59 Ca 0.20 -0.01 -0.09 0.00 3.14 0.00 0.00 58.73 61.96 1s7u h TYR 59 Cb 0.34 0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.74 1s7u h TYR 59 CO 0.02 -0.25 -0.35 -1.49 -1.64 0.00 0.00 178.16 174.46 1s7u h TRP 60 N -0.42 0.27 -0.26 -3.82 4.06 -1.48 -1.91 115.95 112.39 1s7u h TRP 60 Ca -0.04 -0.06 -0.15 0.00 2.06 0.00 0.00 58.89 60.70 1s7u h TRP 60 Cb 0.33 -0.06 -0.00 0.00 -1.00 0.00 0.00 29.16 28.43 1s7u h TRP 60 CO -0.07 0.56 -0.44 1.49 -3.56 0.00 0.00 178.44 176.42 1s7u h GLU 61 N 0.21 0.76 -0.22 0.49 4.57 -1.21 -1.67 114.58 117.51 1s7u h GLU 61 Ca 0.02 -0.47 -0.21 0.00 -1.18 0.00 0.00 59.36 57.53 1s7u h GLU 61 Cb 0.72 0.05 0.01 0.00 -0.16 0.00 0.00 28.75 29.36 1s7u h GLU 61 CO 0.05 1.10 -0.67 0.00 -1.18 0.00 0.00 179.01 178.31 1s7u h ARG 62 N 0.51 0.83 -0.46 1.92 3.08 -1.22 -2.05 114.38 117.00 1s7u h ARG 62 Ca 0.02 -0.60 -0.10 0.00 0.07 0.00 0.00 59.98 59.37 1s7u h ARG 62 Cb 1.04 0.10 -0.02 0.00 0.08 0.00 0.00 29.97 31.17 1s7u h ARG 62 CO 0.10 1.22 -0.11 0.93 -1.07 0.00 0.00 179.97 181.05 1s7u h GLU 63 N 0.60 0.82 -0.22 0.04 4.39 -1.40 -1.34 114.58 117.47 1s7u h GLU 63 Ca -0.02 -0.28 -0.02 0.00 0.34 0.00 0.00 59.36 59.38 1s7u h GLU 63 Cb 1.29 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.87 1s7u h GLU 63 CO 0.14 0.90 0.04 1.15 -1.16 0.00 0.00 179.01 180.08 1s7u h THR 64 N 0.74 1.22 -0.46 1.13 2.02 -1.23 -0.20 112.91 116.13 1s7u h THR 64 Ca 0.12 -0.72 0.01 0.00 0.77 0.00 0.00 66.41 66.59 1s7u h THR 64 Cb 0.60 1.27 -0.02 0.00 -1.74 0.00 0.00 68.15 68.26 1s7u h THR 64 CO 0.04 0.23 0.30 1.56 0.37 0.00 0.00 175.52 178.02 1s7u h GLN 65 N 0.17 0.57 -0.32 6.66 1.08 -1.24 -1.03 115.11 121.01 1s7u h GLN 65 Ca 0.07 -0.03 -0.05 0.00 -1.45 0.00 0.00 58.65 57.19 1s7u h GLN 65 Cb 0.30 -0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 27.59 1s7u h GLN 65 CO 0.00 0.38 0.01 -0.22 -0.95 0.00 0.00 178.83 178.05 1s7u h LYS 66 N 0.59 0.55 -0.84 1.46 3.64 -0.76 -2.49 116.57 118.71 1s7u h LYS 66 Ca 0.17 -0.17 0.01 0.00 -1.27 0.00 0.00 60.65 59.40 1s7u h LYS 66 Cb -0.02 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 31.71 1s7u h LYS 66 CO -0.04 0.67 0.56 0.00 -2.27 0.00 0.00 179.45 178.37 1s7u h ALA 67 N 0.85 1.07 -0.20 5.00 0.00 -0.47 -0.13 119.26 125.39 1s7u h ALA 67 Ca 0.09 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1s7u h ALA 67 Cb 0.42 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1s7u h ALA 67 CO 0.01 0.47 -0.16 0.87 0.00 0.00 0.00 179.25 180.44 1s7u h LYS 68 N 1.14 0.34 -0.43 0.00 1.57 -1.17 0.08 116.57 118.10 1s7u h LYS 68 Ca 0.31 -0.09 -0.10 0.00 -1.87 0.00 0.00 60.65 58.90 1s7u h LYS 68 Cb -0.12 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.14 1s7u h LYS 68 CO -0.07 0.50 -0.11 0.78 -0.57 0.00 0.00 179.45 179.98 1s7u h GLY 69 N 0.88 0.90 1.01 3.86 0.00 -0.92 -2.89 103.07 105.91 1s7u h GLY 69 Ca 0.06 -0.74 0.00 0.00 0.00 0.00 0.00 47.33 46.65 1s7u h GLY 69 CO 0.03 0.68 0.58 1.46 0.00 0.00 0.00 176.54 179.29 1s7u h GLN 70 N 0.65 1.20 -0.70 4.80 1.08 -0.06 -1.21 115.11 120.88 1s7u h GLN 70 Ca 0.11 -0.08 -0.03 0.00 -1.45 0.00 0.00 58.65 57.20 1s7u h GLN 70 Cb 0.64 -0.26 -0.03 0.00 -0.05 0.00 0.00 27.48 27.77 1s7u h GLN 70 CO 0.04 0.81 0.33 1.49 -0.95 0.00 0.00 178.83 180.56 1s7u h GLU 71 N 1.23 1.00 -0.45 1.46 4.81 -0.95 0.16 114.58 121.84 1s7u h GLU 71 Ca 0.33 -0.15 -0.04 0.00 -0.13 0.00 0.00 59.36 59.37 1s7u h GLU 71 Cb -0.11 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.07 1s7u h GLU 71 CO -0.07 0.79 0.12 1.96 -0.73 0.00 0.00 179.01 181.09 1s7u h GLN 72 N 0.97 0.72 -0.49 1.92 1.08 -1.26 -0.71 115.11 117.34 1s7u h GLN 72 Ca 0.24 -0.17 0.08 0.00 -1.45 0.00 0.00 58.65 57.35 1s7u h GLN 72 Cb 0.12 -0.10 -0.07 0.00 -0.05 0.00 0.00 27.48 27.39 1s7u h GLN 72 CO -0.03 0.71 0.10 2.35 -0.95 0.00 0.00 178.83 181.00 1s7u h TRP 73 N 0.60 0.16 -0.30 2.96 7.01 -0.47 -0.54 115.95 125.38 1s7u h TRP 73 Ca 0.14 0.03 -0.11 0.00 2.11 0.00 0.00 58.89 61.06 1s7u h TRP 73 Cb 0.30 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.35 1s7u h TRP 73 CO 0.02 -0.00 -0.27 0.74 -2.79 0.00 0.00 178.44 176.13 1s7u h PHE 74 N 0.23 0.68 -0.07 2.65 -1.00 -0.55 -1.84 116.94 117.05 1s7u h PHE 74 Ca 0.24 -0.16 -0.01 0.00 2.81 0.00 0.00 57.97 60.85 1s7u h PHE 74 Cb 0.32 -0.16 -0.00 0.00 3.61 0.00 0.00 35.95 39.72 1s7u h PHE 74 CO -0.22 0.81 -0.00 -0.09 -1.61 0.00 0.00 178.31 177.19 1s7u h ARG 75 N 0.52 0.13 -0.81 1.51 2.43 -0.63 0.14 114.38 117.67 1s7u h ARG 75 Ca 0.07 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.18 1s7u h ARG 75 Cb 0.74 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.24 1s7u h ARG 75 CO 0.06 0.41 0.43 0.28 -1.51 0.00 0.00 179.97 179.64 1s7u h VAL 76 N -0.17 1.24 0.00 0.20 2.07 -1.05 -2.39 116.25 116.15 1s7u h VAL 76 Ca 0.02 -0.62 -0.12 0.00 0.82 0.00 0.00 66.70 66.80 1s7u h VAL 76 Cb 0.36 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.29 1s7u h VAL 76 CO 0.00 0.28 -0.57 0.77 0.02 0.00 0.00 177.57 178.07 1s7u h SER 77 N 1.12 0.00 -0.59 0.57 4.64 -1.16 -0.17 113.55 117.97 1s7u h SER 77 Ca 0.28 0.00 0.05 0.00 -0.47 0.00 0.00 61.79 61.65 1s7u h SER 77 Cb 0.05 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.10 1s7u h SER 77 CO -0.04 0.57 0.32 -0.07 -0.87 0.00 0.00 176.83 176.73 1s7u h LEU 78 N 0.00 0.47 -0.36 5.97 4.07 -0.50 -0.73 115.31 124.23 1s7u h LEU 78 Ca -0.01 0.03 -0.01 0.00 0.08 0.00 0.00 57.88 57.97 1s7u h LEU 78 Cb 1.27 -0.06 -0.02 0.00 1.08 0.00 0.00 40.66 42.93 1s7u h LEU 78 CO 0.07 0.31 0.19 -0.09 -1.08 0.00 0.00 178.44 177.85 1s7u h ARG 79 N 0.60 0.50 -0.47 1.13 2.43 -0.87 -2.54 114.38 115.17 1s7u h ARG 79 Ca 0.26 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.36 1s7u h ARG 79 Cb 0.15 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 1s7u h ARG 79 CO -0.16 0.43 0.26 -0.91 -1.51 0.00 0.00 179.97 178.08 1s7u h ASN 80 N 0.45 0.58 -0.59 -3.80 2.35 -0.84 -2.97 115.58 110.75 1s7u h ASN 80 Ca 0.13 -0.08 -0.04 0.00 -0.55 0.00 0.00 56.30 55.76 1s7u h ASN 80 Cb 0.08 -0.15 -0.03 0.00 0.05 0.00 0.00 38.32 38.27 1s7u h ASN 80 CO -0.02 0.49 0.24 -0.07 -1.65 0.00 0.00 177.43 176.42 1s7u h LEU 81 N 0.62 0.84 -0.42 1.61 3.38 -1.01 -0.63 115.31 119.70 1s7u h LEU 81 Ca 0.16 -0.11 0.07 0.00 0.09 0.00 0.00 57.88 58.09 1s7u h LEU 81 Cb 0.04 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 40.51 1s7u h LEU 81 CO -0.03 0.75 0.08 0.25 0.09 0.00 0.00 178.44 179.58 1s7u h LEU 82 N 0.90 -0.01 -0.31 1.67 5.85 -1.32 0.38 115.31 122.48 1s7u h LEU 82 Ca 0.21 0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.99 1s7u h LEU 82 Cb 0.19 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 1s7u h LEU 82 CO -0.02 0.03 0.14 1.23 -0.34 0.00 0.00 178.44 179.49 1s7u h GLY 83 N 0.20 0.49 0.92 3.75 0.00 -1.19 -1.38 103.07 105.87 1s7u h GLY 83 Ca 0.20 -0.25 0.04 0.00 0.00 0.00 0.00 47.33 47.33 1s7u h GLY 83 CO -0.27 0.24 0.62 -0.97 0.00 0.00 0.00 176.54 176.15 1s7u h TYR 84 N 0.36 1.14 -0.57 5.60 0.05 -0.47 -2.46 116.97 120.62 1s7u h TYR 84 Ca 0.11 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.91 1s7u h TYR 84 Cb 0.14 -0.38 0.00 0.00 1.01 0.00 0.00 36.73 37.50 1s7u h TYR 84 CO -0.01 0.64 0.00 0.66 -1.05 0.00 0.00 178.16 178.40 1s7u n TYR 85 N -4.45 0.75 -4.20 4.88 4.01 0.06 -4.86 117.16 113.36 1s7u n TYR 85 Ca 0.13 -0.38 -0.31 0.00 -0.16 0.00 0.00 57.90 57.18 1s7u n TYR 85 Cb 0.12 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.09 1s7u n TYR 85 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1s7u n ASN 86 N 1.19 -0.43 -4.80 7.72 5.15 -0.69 -4.94 115.26 118.46 1s7u n ASN 86 Ca 0.19 -1.14 -0.38 0.00 -0.60 0.00 0.00 54.58 52.66 1s7u n ASN 86 Cb 0.49 -2.30 -0.06 0.00 -0.53 0.00 0.00 39.78 37.38 1s7u n ASN 86 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1s7u s GLN 87 N -7.00 3.99 0.00 1.20 -0.21 -0.61 -5.05 119.66 111.98 1s7u s GLN 87 Ca 0.20 0.31 0.00 0.00 0.02 0.00 0.00 55.36 55.89 1s7u s GLN 87 Cb -0.11 -3.28 0.00 0.00 1.00 0.00 0.00 33.01 30.61 1s7u s GLN 87 CO 0.95 0.54 0.00 0.43 -2.12 0.00 0.00 175.29 175.10 1s7u n SER 88 N 2.41 0.00 -4.93 5.90 7.64 -1.26 -4.70 113.62 118.68 1s7u n SER 88 Ca -0.13 -0.53 -0.25 0.00 1.01 0.00 0.00 58.87 58.96 1s7u n SER 88 Cb 0.52 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.73 1s7u n SER 88 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1s7u s ALA 89 N -3.21 3.52 0.00 -0.43 0.00 -1.26 -4.58 121.76 115.80 1s7u s ALA 89 Ca 0.00 -0.78 0.00 0.00 0.00 0.00 0.00 51.96 51.18 1s7u s ALA 89 Cb 0.00 -2.39 0.00 0.00 0.00 0.00 0.00 23.12 20.73 1s7u s ALA 89 CO 0.00 -0.44 0.00 0.41 0.00 0.00 0.00 175.76 175.73 1s7u n GLY 90 N -2.23 1.38 3.45 0.00 0.00 -1.26 -5.09 105.19 101.44 1s7u n GLY 90 Ca 0.01 -0.33 -0.22 0.00 0.00 0.00 0.00 46.02 45.48 1s7u n GLY 90 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1s7u s GLY 91 N -2.38 2.17 -0.15 -0.02 0.00 -1.26 -4.88 107.32 100.80 1s7u s GLY 91 Ca 0.00 -1.82 -0.06 0.00 0.00 0.00 0.00 44.72 42.83 1s7u s GLY 91 CO 0.00 -1.80 0.07 -0.56 0.00 0.00 0.00 173.10 170.81 1s7u s SER 92 N -3.50 5.73 0.05 1.64 0.01 -1.26 -3.51 113.70 112.87 1s7u s SER 92 Ca 0.33 0.18 0.02 0.00 1.31 0.00 0.00 55.95 57.79 1s7u s SER 92 Cb 0.07 -1.89 -0.03 0.00 0.21 0.00 0.00 66.02 64.38 1s7u s SER 92 CO 0.15 0.27 -0.07 -1.00 0.41 0.00 0.00 173.24 173.00 1s7u s HIS 93 N -0.19 0.68 -0.02 2.43 0.09 -0.90 -5.01 115.29 112.38 1s7u s HIS 93 Ca 0.08 -0.63 -0.00 0.00 -0.00 0.00 0.00 55.06 54.50 1s7u s HIS 93 Cb -0.12 -0.41 0.02 0.00 -0.00 0.00 0.00 32.58 32.07 1s7u s HIS 93 CO 0.01 -0.12 0.03 0.99 -0.00 0.00 0.00 174.74 175.65 1s7u s THR 94 N -2.07 -0.05 -0.13 1.30 2.01 -1.26 -1.16 115.64 114.28 1s7u s THR 94 Ca -0.04 0.17 0.02 0.00 0.31 0.00 0.00 61.69 62.14 1s7u s THR 94 Cb -0.05 -0.08 0.01 0.00 0.01 0.00 0.00 72.50 72.39 1s7u s THR 94 CO -0.02 0.07 -0.19 -0.22 -0.69 0.00 0.00 174.62 173.57 1s7u s LEU 95 N 0.84 1.96 0.07 4.42 2.96 -0.56 -0.80 118.68 127.57 1s7u s LEU 95 Ca -0.07 -0.54 0.09 0.00 -0.22 0.00 0.00 54.13 53.39 1s7u s LEU 95 Cb -0.10 -1.32 -0.03 0.00 0.50 0.00 0.00 46.19 45.24 1s7u s LEU 95 CO -0.03 0.05 -0.24 -1.10 -1.32 0.00 0.00 176.35 173.72 1s7u s GLN 96 N 0.93 1.44 -0.02 1.98 -0.21 0.14 -1.27 119.66 122.65 1s7u s GLN 96 Ca -0.06 -1.12 0.02 0.00 0.02 0.00 0.00 55.36 54.23 1s7u s GLN 96 Cb -0.15 -1.68 0.00 0.00 1.00 0.00 0.00 33.01 32.18 1s7u s GLN 96 CO -0.03 0.42 -0.07 -1.14 -2.12 0.00 0.00 175.29 172.35 1s7u s GLN 97 N -1.53 0.72 -0.07 2.91 0.74 -0.04 -0.72 119.66 121.67 1s7u s GLN 97 Ca 0.10 -0.24 0.05 0.00 0.05 0.00 0.00 55.36 55.32 1s7u s GLN 97 Cb -0.10 -0.70 -0.00 0.00 1.10 0.00 0.00 33.01 33.31 1s7u s GLN 97 CO 0.03 0.10 -0.23 -1.64 -0.55 0.00 0.00 175.29 172.99 1s7u s MET 98 N 0.14 2.66 0.10 1.67 -1.94 -0.32 -0.96 119.30 120.65 1s7u s MET 98 Ca -0.02 -0.85 -0.08 0.00 -1.71 0.00 0.00 55.69 53.03 1s7u s MET 98 Cb -0.07 -2.14 -0.01 0.00 2.01 0.00 0.00 34.83 34.63 1s7u s MET 98 CO -0.00 0.27 0.19 -1.54 -0.01 0.00 0.00 175.02 173.93 1s7u s SER 99 N 0.10 0.13 0.00 3.03 1.04 -0.59 -1.22 113.70 116.18 1s7u s SER 99 Ca -0.11 -0.71 0.00 0.00 0.48 0.00 0.00 55.95 55.61 1s7u s SER 99 Cb -0.15 0.35 0.00 0.00 0.10 0.00 0.00 66.02 66.31 1s7u s SER 99 CO 0.06 -0.75 0.00 0.61 0.98 0.00 0.00 173.24 174.14 1s7u n GLY 100 N -0.08 0.11 3.09 7.32 0.00 -0.69 -0.87 105.19 114.08 1s7u n GLY 100 Ca -0.14 -1.63 -0.15 0.00 0.00 0.00 0.00 46.02 44.10 1s7u n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s7u s ASP 102 N -1.49 4.71 -0.02 0.00 1.01 -0.17 -1.15 116.67 119.56 1s7u s ASP 102 Ca -0.06 -0.10 0.02 0.00 0.71 0.00 0.00 52.55 53.12 1s7u s ASP 102 Cb -0.09 -1.59 -0.03 0.00 1.01 0.00 0.00 42.92 42.21 1s7u s ASP 102 CO 0.01 0.23 -0.05 -0.76 0.21 0.00 0.00 175.17 174.81 1s7u s LEU 103 N -0.02 3.24 1.20 1.23 1.43 0.73 -0.40 118.68 126.09 1s7u s LEU 103 Ca 0.00 -0.07 -0.19 0.00 -1.03 0.00 0.00 54.13 52.84 1s7u s LEU 103 Cb -0.13 -1.81 0.29 0.00 0.03 0.00 0.00 46.19 44.57 1s7u s LEU 103 CO 0.03 0.31 1.12 -0.83 0.23 0.00 0.00 176.35 177.22 1s7u s GLY 104 N -1.22 1.60 0.53 -3.19 0.00 -0.42 -1.65 107.32 102.96 1s7u s GLY 104 Ca 0.16 -1.01 0.35 0.00 0.00 0.00 0.00 44.72 44.22 1s7u s GLY 104 CO 0.06 -0.11 2.03 1.48 0.00 0.00 0.00 173.10 176.56 1s7u h SER 105 N -2.57 0.00 0.00 1.64 4.64 -1.90 -1.41 113.55 113.94 1s7u h SER 105 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 1s7u h SER 105 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1s7u h SER 105 CO 0.33 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.39 1s7u n ASP 106 N -2.91 0.00 -0.47 4.97 5.75 -1.26 -4.43 116.55 118.20 1s7u n ASP 106 Ca -0.00 -1.23 -0.06 0.00 -0.01 0.00 0.00 54.79 53.49 1s7u n ASP 106 Cb 0.21 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.27 1s7u n ASP 106 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 1s7u n TRP 107 N -0.81 0.00 -3.73 2.11 7.02 -0.53 -5.00 117.44 116.49 1s7u n TRP 107 Ca 0.13 0.00 -0.34 0.00 -1.02 0.00 0.00 57.50 56.28 1s7u n TRP 107 Cb 0.06 -1.84 -0.05 0.00 -2.42 0.00 0.00 31.31 27.06 1s7u n TRP 107 CO 0.00 0.00 0.00 0.50 -2.02 0.00 0.00 177.69 176.17 1s7u s ARG 108 N -2.15 3.60 -0.10 -0.99 6.06 -1.26 -4.83 118.95 119.28 1s7u s ARG 108 Ca 0.00 -0.08 -0.29 0.00 -2.50 0.00 0.00 55.73 52.85 1s7u s ARG 108 Cb 0.00 -3.01 -0.07 0.00 0.06 0.00 0.00 34.95 31.92 1s7u s ARG 108 CO 0.00 0.59 2.10 -0.11 -2.50 0.00 0.00 175.30 175.38 1s7u n LEU 109 N 0.78 3.64 -0.08 -0.88 7.94 -1.26 -1.30 117.00 125.84 1s7u n LEU 109 Ca -0.08 0.55 -0.15 0.00 -1.11 0.00 0.00 56.01 55.21 1s7u n LEU 109 Cb 0.52 -1.53 -0.12 0.00 0.53 0.00 0.00 43.42 42.82 1s7u n LEU 109 CO 0.44 -0.27 0.19 0.25 -1.11 0.00 0.00 177.39 176.89 1s7u h LEU 110 N 12.78 0.00 -7.31 -1.96 5.85 -1.05 -3.46 115.31 120.17 1s7u h LEU 110 Ca -0.45 -0.88 -0.11 0.00 0.84 0.00 0.00 57.88 57.29 1s7u h LEU 110 Cb 1.24 0.00 -0.22 0.00 0.37 0.00 0.00 40.66 42.05 1s7u h LEU 110 CO 0.95 1.09 -0.18 -0.60 -0.34 0.00 0.00 178.44 179.36 1s7u s ARG 111 N -2.24 0.60 0.10 1.25 3.52 -1.13 -5.01 118.95 116.04 1s7u s ARG 111 Ca -0.21 0.40 0.02 0.00 -0.13 0.00 0.00 55.73 55.82 1s7u s ARG 111 Cb -0.01 0.29 -0.04 0.00 -1.56 0.00 0.00 34.95 33.63 1s7u s ARG 111 CO 0.65 -0.11 0.15 0.20 -0.81 0.00 0.00 175.30 175.38 1s7u s GLY 112 N -0.25 1.97 -0.02 8.12 0.00 -1.26 -1.00 107.32 114.88 1s7u s GLY 112 Ca -0.04 -1.01 0.02 0.00 0.00 0.00 0.00 44.72 43.69 1s7u s GLY 112 CO 0.02 -0.99 -0.07 -0.19 0.00 0.00 0.00 173.10 171.87 1s7u s TYR 113 N -1.54 0.75 -0.29 1.90 2.02 -0.11 -4.81 117.35 115.28 1s7u s TYR 113 Ca 0.32 -0.16 0.03 0.00 -0.37 0.00 0.00 57.07 56.88 1s7u s TYR 113 Cb -0.12 -0.53 0.18 0.00 -0.40 0.00 0.00 41.96 41.10 1s7u s TYR 113 CO 0.25 -0.06 0.54 -1.17 -1.57 0.00 0.00 175.55 173.54 1s7u s LEU 114 N 0.09 -1.33 0.03 -1.29 1.98 -1.25 -1.70 118.68 115.22 1s7u s LEU 114 Ca -0.01 0.23 0.02 0.00 -2.89 0.00 0.00 54.13 51.47 1s7u s LEU 114 Cb -0.06 1.81 -0.02 0.00 0.66 0.00 0.00 46.19 48.57 1s7u s LEU 114 CO -0.00 -0.30 -0.07 -1.10 -1.89 0.00 0.00 176.35 172.99 1s7u s GLN 115 N 2.76 0.49 0.03 1.98 -0.21 -0.36 -0.47 119.66 123.87 1s7u s GLN 115 Ca 0.13 -0.67 0.04 0.00 0.02 0.00 0.00 55.36 54.87 1s7u s GLN 115 Cb -0.12 -0.26 -0.02 0.00 1.00 0.00 0.00 33.01 33.61 1s7u s GLN 115 CO -0.25 0.05 -0.12 -0.06 -2.12 0.00 0.00 175.29 172.79 1s7u s PHE 116 N -1.23 1.02 0.03 0.91 0.40 0.09 -1.18 117.98 118.02 1s7u s PHE 116 Ca -0.09 -0.32 0.07 0.00 -0.60 0.00 0.00 56.93 55.99 1s7u s PHE 116 Cb -0.09 -0.62 -0.02 0.00 0.51 0.00 0.00 43.02 42.80 1s7u s PHE 116 CO 0.00 0.00 -0.20 0.00 0.70 0.00 0.00 175.22 175.72 1s7u s ALA 117 N -0.75 1.72 -0.10 5.36 0.00 0.10 -0.80 121.76 127.28 1s7u s ALA 117 Ca 0.00 -1.01 0.03 0.00 0.00 0.00 0.00 51.96 50.98 1s7u s ALA 117 Cb -0.07 -0.35 -0.00 0.00 0.00 0.00 0.00 23.12 22.69 1s7u s ALA 117 CO 0.01 0.39 -0.22 -0.47 0.00 0.00 0.00 175.76 175.47 1s7u s TYR 118 N -0.74 2.59 -1.65 0.00 5.04 -0.04 -0.69 117.35 121.87 1s7u s TYR 118 Ca 0.07 -0.97 0.00 0.00 -2.44 0.00 0.00 57.07 53.74 1s7u s TYR 118 Cb -0.09 -1.73 0.00 0.00 0.35 0.00 0.00 41.96 40.50 1s7u s TYR 118 CO 0.01 -0.37 0.00 0.39 -1.34 0.00 0.00 175.55 174.24 1s7u n GLU 119 N 3.49 -1.76 -0.84 4.97 -0.58 0.02 -1.47 120.64 124.46 1s7u n GLU 119 Ca -0.19 0.93 0.00 0.00 -0.42 0.00 0.00 57.16 57.48 1s7u n GLU 119 Cb 0.53 -5.52 0.00 0.00 -0.57 0.00 0.00 31.44 25.88 1s7u n GLU 119 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1s7u n GLY 120 N -0.84 0.57 3.22 0.62 0.00 -1.26 -5.01 105.19 102.50 1s7u n GLY 120 Ca -0.21 -0.06 -0.24 0.00 0.00 0.00 0.00 46.02 45.50 1s7u n GLY 120 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1s7u s ARG 121 N -0.26 1.27 0.02 1.61 0.52 -0.54 -5.05 118.95 116.50 1s7u s ARG 121 Ca 0.00 -0.88 -0.36 0.00 -0.52 0.00 0.00 55.73 53.97 1s7u s ARG 121 Cb 0.00 -1.35 -0.15 0.00 0.52 0.00 0.00 34.95 33.97 1s7u s ARG 121 CO 0.00 0.34 1.54 -0.25 0.02 0.00 0.00 175.30 176.96 1s7u n ASP 122 N 1.89 2.38 -0.01 0.23 8.00 -1.26 -0.86 116.55 126.93 1s7u n ASP 122 Ca -0.17 1.08 -0.02 0.00 0.71 0.00 0.00 54.79 56.39 1s7u n ASP 122 Cb 0.54 -1.27 -0.01 0.00 -0.02 0.00 0.00 41.12 40.36 1s7u n ASP 122 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1s7u n TYR 123 N 3.79 0.00 -3.84 1.24 9.36 0.02 -4.78 117.16 122.95 1s7u n TYR 123 Ca 0.20 0.00 -0.12 0.00 3.32 0.00 0.00 57.90 61.30 1s7u n TYR 123 Cb 0.22 -0.13 -0.10 0.00 -0.63 0.00 0.00 39.34 38.69 1s7u n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 1s7u s ILE 124 N -1.79 0.06 -0.07 2.97 2.07 -1.17 -4.14 121.20 119.13 1s7u s ILE 124 Ca -0.08 -0.50 -0.07 0.00 -1.41 0.00 0.00 60.65 58.59 1s7u s ILE 124 Cb 0.01 -0.43 0.02 0.00 0.13 0.00 0.00 42.46 42.19 1s7u s ILE 124 CO 0.11 -0.27 0.20 0.00 -1.91 0.00 0.00 174.94 173.07 1s7u s ALA 125 N -1.03 -0.50 -0.02 1.50 0.00 -0.26 -0.73 121.76 120.73 1s7u s ALA 125 Ca -0.11 0.55 -0.30 0.00 0.00 0.00 0.00 51.96 52.10 1s7u s ALA 125 Cb -0.06 -0.32 -0.03 0.00 0.00 0.00 0.00 23.12 22.71 1s7u s ALA 125 CO 0.02 -0.10 1.08 -1.17 0.00 0.00 0.00 175.76 175.59 1s7u s LEU 126 N 0.04 4.33 0.80 0.00 2.96 0.38 -0.69 118.68 126.51 1s7u s LEU 126 Ca -0.01 1.75 -0.11 0.00 -0.22 0.00 0.00 54.13 55.55 1s7u s LEU 126 Cb -0.02 -3.57 0.07 0.00 0.50 0.00 0.00 46.19 43.18 1s7u s LEU 126 CO 0.00 -0.41 1.09 0.20 -1.32 0.00 0.00 176.35 175.91 1s7u s ASN 127 N 1.13 4.27 0.51 3.68 0.01 0.07 -4.60 114.94 120.00 1s7u s ASN 127 Ca 0.54 1.71 0.26 0.00 -0.71 0.00 0.00 52.86 54.66 1s7u s ASN 127 Cb -0.23 -2.42 1.36 0.00 0.41 0.00 0.00 41.25 40.38 1s7u s ASN 127 CO 0.25 -2.17 1.93 -0.08 -1.51 0.00 0.00 177.10 175.53 1s7u h GLU 128 N -1.22 0.08 0.00 -0.60 4.81 -1.88 0.49 114.58 116.25 1s7u h GLU 128 Ca -0.45 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 1s7u h GLU 128 Cb 1.24 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.61 1s7u h GLU 128 CO 0.53 0.05 0.00 -0.40 -0.73 0.00 0.00 179.01 178.46 1s7u n ASP 129 N -4.36 0.53 -1.75 1.04 5.75 -1.26 -4.73 116.55 111.77 1s7u n ASP 129 Ca 0.15 0.69 -0.18 0.00 -0.01 0.00 0.00 54.79 55.43 1s7u n ASP 129 Cb 0.75 -0.78 -0.04 0.00 -1.03 0.00 0.00 41.12 40.02 1s7u n ASP 129 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1s7u n LEU 130 N -2.15 -1.59 0.00 -2.12 4.77 0.16 -4.78 117.00 111.30 1s7u n LEU 130 Ca 0.00 0.19 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 1s7u n LEU 130 Cb 0.12 -2.57 0.00 0.00 -2.33 0.00 0.00 43.42 38.64 1s7u n LEU 130 CO 0.14 -0.53 -0.23 0.29 -1.33 0.00 0.00 177.39 175.72 1s7u n LYS 131 N -2.61 0.93 -4.52 3.23 5.02 -1.26 -4.57 118.16 114.38 1s7u n LYS 131 Ca -0.20 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 55.85 1s7u n LYS 131 Cb 0.63 -0.73 -0.11 0.00 -0.02 0.00 0.00 35.03 34.80 1s7u n LYS 131 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1s7u s THR 132 N -1.47 1.98 0.01 -0.18 -4.23 -1.26 -4.85 115.64 105.64 1s7u s THR 132 Ca 0.00 -2.14 0.07 0.00 -1.18 0.00 0.00 61.69 58.44 1s7u s THR 132 Cb 0.00 -2.65 -0.03 0.00 1.34 0.00 0.00 72.50 71.17 1s7u s THR 132 CO 0.00 -0.19 -0.21 0.26 -0.54 0.00 0.00 174.62 173.94 1s7u s TRP 133 N -2.78 2.48 -0.22 3.99 0.52 -1.26 -0.76 118.94 120.91 1s7u s TRP 133 Ca 0.32 -0.32 -0.06 0.00 0.02 0.00 0.00 56.10 56.06 1s7u s TRP 133 Cb 0.04 -1.48 -0.03 0.00 -1.15 0.00 0.00 33.47 30.85 1s7u s TRP 133 CO 0.15 0.15 0.03 0.99 0.02 0.00 0.00 176.95 178.29 1s7u s THR 134 N -0.79 4.14 -0.23 2.01 2.01 0.13 -4.91 115.64 118.00 1s7u s THR 134 Ca 0.12 -0.24 -0.03 0.00 0.31 0.00 0.00 61.69 61.85 1s7u s THR 134 Cb -0.10 -2.90 0.11 0.00 0.01 0.00 0.00 72.50 69.61 1s7u s THR 134 CO 0.02 0.39 0.26 0.00 -0.69 0.00 0.00 174.62 174.60 1s7u s ALA 135 N 1.29 -0.45 -0.10 7.40 0.00 -1.26 -1.10 121.76 127.53 1s7u s ALA 135 Ca 0.04 0.28 -0.27 0.00 0.00 0.00 0.00 51.96 52.02 1s7u s ALA 135 Cb -0.15 -1.47 -0.23 0.00 0.00 0.00 0.00 23.12 21.28 1s7u s ALA 135 CO 0.02 -1.30 0.90 0.00 0.00 0.00 0.00 175.76 175.37 1s7u h ALA 136 N 8.28 -0.01 -2.97 0.00 0.00 -1.89 -3.45 119.26 119.22 1s7u h ALA 136 Ca -0.17 -0.39 -0.54 0.00 0.00 0.00 0.00 54.91 53.80 1s7u h ALA 136 Cb 1.14 0.01 0.13 0.00 0.00 0.00 0.00 17.79 19.07 1s7u h ALA 136 CO 0.29 -0.09 0.53 -0.51 0.00 0.00 0.00 179.25 179.47 1s7u s ASP 137 N -6.00 5.10 0.17 0.00 1.11 -1.26 -4.91 116.67 110.88 1s7u s ASP 137 Ca -0.17 2.58 -0.14 0.00 0.18 0.00 0.00 52.55 54.99 1s7u s ASP 137 Cb -0.01 -2.62 0.06 0.00 1.07 0.00 0.00 42.92 41.42 1s7u s ASP 137 CO 0.65 -1.67 1.83 0.24 1.18 0.00 0.00 175.17 177.41 1s7u h MET 138 N 1.05 0.70 -0.80 8.23 2.86 -2.00 -2.11 114.93 122.86 1s7u h MET 138 Ca -0.51 -0.05 0.08 0.00 -2.06 0.00 0.00 59.70 57.16 1s7u h MET 138 Cb 1.31 -0.16 -0.06 0.00 0.06 0.00 0.00 31.60 32.75 1s7u h MET 138 CO 0.56 0.47 0.47 0.00 1.06 0.00 0.00 176.91 179.46 1s7u h ALA 139 N 1.19 1.11 0.00 6.32 0.00 -1.91 -2.12 119.26 123.85 1s7u h ALA 139 Ca 0.19 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1s7u h ALA 139 Cb -0.07 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.56 1s7u h ALA 139 CO -0.04 0.14 0.00 0.00 0.00 0.00 0.00 179.25 179.35 1s7u n ALA 140 N -2.36 1.50 0.19 0.00 0.00 -0.81 -2.28 120.51 116.74 1s7u n ALA 140 Ca 0.12 0.07 0.02 0.00 0.00 0.00 0.00 53.44 53.66 1s7u n ALA 140 Cb 0.22 -1.32 0.36 0.00 0.00 0.00 0.00 19.45 18.71 1s7u n ALA 140 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1s7u h GLN 141 N 0.00 0.00 0.51 0.00 1.08 -1.18 -1.26 115.11 114.26 1s7u h GLN 141 Ca 0.00 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.18 1s7u h GLN 141 Cb 0.25 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.68 1s7u h GLN 141 CO 0.00 0.37 -0.30 0.82 -0.95 0.00 0.00 178.83 178.77 1s7u h ILE 142 N 0.00 0.38 -0.48 2.54 2.04 -1.61 -1.18 117.51 119.20 1s7u h ILE 142 Ca -0.00 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.92 1s7u h ILE 142 Cb 0.66 0.38 -0.05 0.00 -0.74 0.00 0.00 36.82 37.06 1s7u h ILE 142 CO 0.05 0.00 0.19 0.74 0.00 0.00 0.00 178.15 179.13 1s7u h THR 143 N -0.77 0.87 -0.50 -0.27 2.02 -1.67 -1.91 112.91 110.67 1s7u h THR 143 Ca -0.06 -0.13 0.04 0.00 0.77 0.00 0.00 66.41 67.03 1s7u h THR 143 Cb 0.62 0.46 -0.04 0.00 -1.74 0.00 0.00 68.15 67.45 1s7u h THR 143 CO 0.07 0.07 0.26 -0.09 0.37 0.00 0.00 175.52 176.19 1s7u h ARG 144 N 0.37 0.49 -0.34 6.66 2.43 -1.04 0.32 114.38 123.27 1s7u h ARG 144 Ca 0.22 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.35 1s7u h ARG 144 Cb 0.21 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 1s7u h ARG 144 CO -0.21 0.32 0.13 0.00 -1.51 0.00 0.00 179.97 178.70 1s7u h ARG 145 N 0.50 0.51 -0.43 0.20 3.08 -0.96 -0.60 114.38 116.68 1s7u h ARG 145 Ca 0.22 -0.09 0.07 0.00 0.07 0.00 0.00 59.98 60.24 1s7u h ARG 145 Cb 0.12 -0.08 -0.06 0.00 0.08 0.00 0.00 29.97 30.03 1s7u h ARG 145 CO -0.15 0.50 0.10 -0.22 -1.07 0.00 0.00 179.97 179.13 1s7u h LYS 146 N 0.40 0.23 0.00 0.04 3.64 -0.98 -1.26 116.57 118.64 1s7u h LYS 146 Ca 0.11 -0.01 -0.15 0.00 -1.27 0.00 0.00 60.65 59.33 1s7u h LYS 146 Cb 0.19 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 1s7u h LYS 146 CO -0.01 0.15 -0.71 -1.49 -2.27 0.00 0.00 179.45 175.12 1s7u h TRP 147 N 0.23 0.00 -0.19 1.91 4.06 -0.75 -2.43 115.95 118.78 1s7u h TRP 147 Ca 0.21 0.00 -0.11 0.00 2.06 0.00 0.00 58.89 61.05 1s7u h TRP 147 Cb 0.25 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.41 1s7u h TRP 147 CO -0.20 0.71 -0.29 0.93 -3.56 0.00 0.00 178.44 176.03 1s7u h GLU 148 N 0.00 0.53 0.00 0.49 5.08 -0.92 -0.60 114.58 119.16 1s7u h GLU 148 Ca -0.01 -0.32 -0.06 0.00 -1.00 0.00 0.00 59.36 57.97 1s7u h GLU 148 Cb 1.36 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.63 1s7u h GLU 148 CO 0.09 0.92 -0.29 1.96 -1.00 0.00 0.00 179.01 180.70 1s7u h GLN 149 N 0.19 0.00 -0.00 2.33 4.20 -1.21 -3.07 115.11 117.55 1s7u h GLN 149 Ca 0.02 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.73 1s7u h GLN 149 Cb 0.87 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.65 1s7u h GLN 149 CO 0.07 0.29 -0.52 -1.13 -0.67 0.00 0.00 178.83 176.86 1s7u n SER 150 N -3.40 0.66 -0.76 1.46 3.41 -0.92 -4.97 113.62 109.11 1s7u n SER 150 Ca 0.00 -0.46 -0.05 0.00 -0.26 0.00 0.00 58.87 58.10 1s7u n SER 150 Cb 0.48 0.33 0.00 0.00 -0.26 0.00 0.00 64.21 64.76 1s7u n SER 150 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1s7u n GLY 151 N 1.48 0.26 0.34 5.00 0.00 -1.08 -4.97 105.19 106.22 1s7u n GLY 151 Ca 0.06 -0.61 0.02 0.00 0.00 0.00 0.00 46.02 45.49 1s7u n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s7u h ALA 152 N 0.25 1.27 -0.96 4.61 0.00 -1.39 -2.80 119.26 120.24 1s7u h ALA 152 Ca -0.13 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.82 1s7u h ALA 152 Cb 1.09 -0.25 -0.06 0.00 0.00 0.00 0.00 17.79 18.57 1s7u h ALA 152 CO 0.14 0.32 0.63 0.00 0.00 0.00 0.00 179.25 180.34 1s7u h ALA 153 N 1.43 1.41 -0.42 0.00 0.00 -1.89 -2.20 119.26 117.59 1s7u h ALA 153 Ca 0.40 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.23 1s7u h ALA 153 Cb 0.20 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1s7u h ALA 153 CO -0.18 0.48 0.07 0.93 0.00 0.00 0.00 179.25 180.54 1s7u h GLU 154 N 1.17 0.69 -0.22 0.00 3.07 -1.74 0.24 114.58 117.79 1s7u h GLU 154 Ca 0.39 -0.19 0.06 0.00 -0.50 0.00 0.00 59.36 59.13 1s7u h GLU 154 Cb 0.08 -0.08 -0.07 0.00 -0.84 0.00 0.00 28.75 27.84 1s7u h GLU 154 CO -0.13 0.73 -0.23 1.25 -1.40 0.00 0.00 179.01 179.23 1s7u h HIS 155 N 0.54 -0.61 -0.45 4.33 -0.00 -1.40 -2.36 115.15 115.21 1s7u h HIS 155 Ca 0.13 0.04 -0.09 0.00 -0.00 0.00 0.00 60.37 60.44 1s7u h HIS 155 Cb 0.38 0.30 -0.02 0.00 -0.00 0.00 0.00 27.41 28.07 1s7u h HIS 155 CO 0.03 -0.31 -0.10 1.88 -0.00 0.00 0.00 177.93 179.43 1s7u h TYR 156 N -0.24 0.88 -0.84 5.26 0.05 -1.23 -2.75 116.97 118.10 1s7u h TYR 156 Ca 0.13 -0.16 0.00 0.00 0.05 0.00 0.00 58.73 58.75 1s7u h TYR 156 Cb 0.44 -0.23 -0.04 0.00 1.01 0.00 0.00 36.73 37.92 1s7u h TYR 156 CO -0.38 0.86 0.53 -0.22 -1.05 0.00 0.00 178.16 177.91 1s7u h LYS 157 N 0.73 1.13 -0.57 4.88 3.64 -0.83 -0.56 116.57 125.00 1s7u h LYS 157 Ca 0.12 -0.08 -0.11 0.00 -1.27 0.00 0.00 60.65 59.31 1s7u h LYS 157 Cb 0.59 -0.25 -0.02 0.00 -0.41 0.00 0.00 32.23 32.14 1s7u h LYS 157 CO 0.04 0.77 -0.08 0.00 -2.27 0.00 0.00 179.45 177.91 1s7u h ALA 158 N 1.43 0.77 -0.04 5.00 0.00 -1.27 0.61 119.26 125.77 1s7u h ALA 158 Ca 0.31 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1s7u h ALA 158 Cb -0.09 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 1s7u h ALA 158 CO -0.06 0.67 0.03 -0.92 0.00 0.00 0.00 179.25 178.97 1s7u h TYR 159 N 0.94 0.06 -0.15 0.00 3.20 -1.16 -1.04 116.97 118.82 1s7u h TYR 159 Ca 0.15 -0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.90 1s7u h TYR 159 Cb 0.65 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.89 1s7u h TYR 159 CO 0.05 0.08 -0.44 -0.07 -1.64 0.00 0.00 178.16 176.13 1s7u h LEU 160 N 0.02 0.38 0.00 2.82 3.38 -0.84 -0.09 115.31 120.98 1s7u h LEU 160 Ca 0.02 -0.17 -0.11 0.00 0.09 0.00 0.00 57.88 57.71 1s7u h LEU 160 Cb 0.04 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1s7u h LEU 160 CO -0.00 0.78 -0.82 -0.33 0.09 0.00 0.00 178.44 178.15 1s7u h GLU 161 N 0.29 0.00 0.00 1.13 5.08 -0.91 -3.35 114.58 116.81 1s7u h GLU 161 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1s7u h GLU 161 Cb 0.90 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.15 1s7u h GLU 161 CO 0.07 0.34 0.00 0.41 -1.00 0.00 0.00 179.01 178.84 1s7u n GLY 162 N 1.27 0.34 0.26 -3.84 0.00 -0.40 -4.62 105.19 98.20 1s7u n GLY 162 Ca -0.02 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.99 1s7u n GLY 162 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1s7u h GLU 163 N 0.00 -0.03 -0.48 1.61 5.08 -1.58 -0.50 114.58 118.68 1s7u h GLU 163 Ca 0.00 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.43 1s7u h GLU 163 Cb 0.00 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.20 1s7u h GLU 163 CO 0.00 -0.02 0.16 0.00 -1.00 0.00 0.00 179.01 178.15 1s7u h VAL 165 N 0.32 1.18 -0.78 0.00 2.07 -1.55 -2.42 116.25 115.07 1s7u h VAL 165 Ca 0.23 -0.80 -0.01 0.00 0.82 0.00 0.00 66.70 66.94 1s7u h VAL 165 Cb 0.25 1.70 -0.04 0.00 -1.52 0.00 0.00 31.29 31.68 1s7u h VAL 165 CO -0.25 0.20 0.44 -0.33 0.02 0.00 0.00 177.57 177.66 1s7u h GLU 166 N -0.43 1.07 0.00 1.57 5.08 -0.94 -1.47 114.58 119.46 1s7u h GLU 166 Ca -0.01 -0.11 -0.17 0.00 -1.00 0.00 0.00 59.36 58.07 1s7u h GLU 166 Cb 0.38 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 1s7u h GLU 166 CO 0.01 0.78 -0.82 -1.49 -1.00 0.00 0.00 179.01 176.49 1s7u h TRP 167 N 1.07 0.00 -0.32 4.33 4.06 -1.14 -2.80 115.95 121.16 1s7u h TRP 167 Ca 0.28 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 61.20 1s7u h TRP 167 Cb 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.15 1s7u h TRP 167 CO -0.00 0.82 0.09 1.25 -3.56 0.00 0.00 178.44 177.04 1s7u h LEU 168 N 0.00 0.46 -0.50 -4.49 5.85 -1.08 -1.39 115.31 114.17 1s7u h LEU 168 Ca -0.01 -0.21 0.10 0.00 0.84 0.00 0.00 57.88 58.60 1s7u h LEU 168 Cb 1.48 -0.12 -0.08 0.00 0.37 0.00 0.00 40.66 42.30 1s7u h LEU 168 CO 0.11 0.55 0.02 0.45 -0.34 0.00 0.00 178.44 179.23 1s7u h HIS 169 N 0.35 0.01 -0.85 1.25 3.86 -1.25 -0.34 115.15 118.18 1s7u h HIS 169 Ca 0.10 0.04 0.03 0.00 -1.16 0.00 0.00 60.37 59.38 1s7u h HIS 169 Cb 0.26 0.07 -0.05 0.00 1.06 0.00 0.00 27.41 28.75 1s7u h HIS 169 CO 0.01 -0.09 0.55 -0.09 0.86 0.00 0.00 177.93 179.17 1s7u h ARG 170 N 0.14 1.05 -0.20 2.45 2.43 -1.31 -2.55 114.38 116.39 1s7u h ARG 170 Ca 0.25 -0.06 -0.14 0.00 -0.81 0.00 0.00 59.98 59.22 1s7u h ARG 170 Cb 0.38 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 1s7u h ARG 170 CO -0.40 0.69 -0.45 1.88 -1.51 0.00 0.00 179.97 180.19 1s7u h TYR 171 N 1.08 0.61 -0.04 2.20 0.05 -0.47 -3.02 116.97 117.38 1s7u h TYR 171 Ca 0.34 -0.19 -0.13 0.00 0.05 0.00 0.00 58.73 58.80 1s7u h TYR 171 Cb -0.02 -0.13 -0.01 0.00 1.01 0.00 0.00 36.73 37.58 1s7u h TYR 171 CO -0.02 0.87 -0.55 -0.07 -1.05 0.00 0.00 178.16 177.33 1s7u h LEU 172 N 0.41 0.14 -0.69 3.88 3.38 -0.82 -2.71 115.31 118.90 1s7u h LEU 172 Ca 0.03 -0.07 -0.14 0.00 0.09 0.00 0.00 57.88 57.79 1s7u h LEU 172 Cb 0.95 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.64 1s7u h LEU 172 CO 0.08 0.67 -0.65 0.11 0.09 0.00 0.00 178.44 178.74 1s7u h LYS 173 N 0.10 0.00 0.09 1.13 1.57 -1.44 -3.28 116.57 114.74 1s7u h LYS 173 Ca -0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1s7u h LYS 173 Cb 1.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.32 1s7u h LYS 173 CO 0.08 0.65 -0.04 -0.91 -0.57 0.00 0.00 179.45 178.66 1s7u h ASN 174 N 0.00 -0.10 -1.84 0.86 4.21 -1.36 -3.38 115.58 113.97 1s7u h ASN 174 Ca -0.01 -0.49 -0.70 0.00 1.21 0.00 0.00 56.30 56.32 1s7u h ASN 174 Cb 1.16 0.03 -0.33 0.00 -1.12 0.00 0.00 38.32 38.05 1s7u h ASN 174 CO 0.08 0.56 0.35 0.61 -1.29 0.00 0.00 177.43 177.74 1s7u n GLY 175 N 0.97 5.73 0.00 2.83 0.00 -1.06 -4.76 105.19 108.91 1s7u n GLY 175 Ca -0.07 -2.60 0.13 0.00 0.00 0.00 0.00 46.02 43.47 1s7u n GLY 175 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1s7u n ASN 176 N -0.49 0.00 -0.63 1.61 2.85 -1.24 -3.02 115.26 114.34 1s7u n ASN 176 Ca 0.47 0.45 0.12 0.00 -0.11 0.00 0.00 54.58 55.51 1s7u n ASN 176 Cb 0.40 -0.48 0.38 0.00 1.24 0.00 0.00 39.78 41.32 1s7u n ASN 176 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1s7u n ALA 177 N -1.48 2.52 -0.07 5.20 0.00 -1.26 -4.11 120.51 121.31 1s7u n ALA 177 Ca 0.07 -0.56 -0.14 0.00 0.00 0.00 0.00 53.44 52.81 1s7u n ALA 177 Cb 0.30 -1.06 -0.05 0.00 0.00 0.00 0.00 19.45 18.64 1s7u n ALA 177 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1s7u n THR 178 N 0.50 0.72 -2.73 0.00 -1.04 -1.17 -4.85 114.28 105.70 1s7u n THR 178 Ca 0.17 -0.19 -0.33 0.00 -2.04 0.00 0.00 64.05 61.67 1s7u n THR 178 Cb 0.39 -1.66 -0.01 0.00 -1.82 0.00 0.00 70.33 67.24 1s7u n THR 178 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1s7u n LEU 179 N -3.57 5.70 -2.67 -4.42 -0.00 -1.22 -4.54 117.00 106.29 1s7u n LEU 179 Ca -0.26 -5.49 -0.09 0.00 -0.00 0.00 0.00 56.01 50.17 1s7u n LEU 179 Cb 0.68 -0.79 0.04 0.00 -0.00 0.00 0.00 43.42 43.35 1s7u n LEU 179 CO 0.02 2.20 -0.07 -0.11 -0.00 0.00 0.00 177.39 179.44 1s7u n LEU 180 N -0.22 1.15 -3.46 1.47 7.94 -1.26 -4.95 117.00 117.66 1s7u n LEU 180 Ca 0.39 -3.69 -0.14 0.00 -1.11 0.00 0.00 56.01 51.46 1s7u n LEU 180 Cb 0.36 0.40 -0.03 0.00 0.53 0.00 0.00 43.42 44.67 1s7u n LEU 180 CO 0.41 1.59 0.43 0.00 -1.11 0.00 0.00 177.39 178.72 1s7u s ARG 181 N -2.83 1.17 0.10 1.96 1.70 -1.26 -5.08 118.95 114.71 1s7u s ARG 181 Ca 0.27 -0.20 0.03 0.00 -0.47 0.00 0.00 55.73 55.36 1s7u s ARG 181 Cb 0.45 0.55 -0.04 0.00 -0.57 0.00 0.00 34.95 35.34 1s7u s ARG 181 CO 0.03 -0.47 -0.09 0.95 -1.08 0.00 0.00 175.30 174.64 1s7u s THR 182 N -2.80 0.92 -0.16 4.99 -4.23 -1.26 -4.94 115.64 108.15 1s7u s THR 182 Ca -0.03 -1.72 -0.02 0.00 -1.18 0.00 0.00 61.69 58.75 1s7u s THR 182 Cb -0.01 -1.44 -0.01 0.00 1.34 0.00 0.00 72.50 72.38 1s7u s THR 182 CO -0.05 -0.62 -0.10 -1.81 -0.54 0.00 0.00 174.62 171.50 1s7u s ASP 183 N -2.60 4.16 0.57 3.99 1.11 -0.66 -4.97 116.67 118.28 1s7u s ASP 183 Ca 0.07 -0.33 -0.17 0.00 0.18 0.00 0.00 52.55 52.30 1s7u s ASP 183 Cb -0.01 -1.66 -0.05 0.00 1.07 0.00 0.00 42.92 42.27 1s7u s ASP 183 CO -0.01 0.10 1.06 -0.44 1.18 0.00 0.00 175.17 177.07 1s7u s SER 184 N 0.72 5.85 -0.09 0.27 0.01 -1.26 -1.27 113.70 117.93 1s7u s SER 184 Ca -0.04 1.88 -0.30 0.00 1.31 0.00 0.00 55.95 58.79 1s7u s SER 184 Cb -0.15 -2.54 -0.03 0.00 0.21 0.00 0.00 66.02 63.51 1s7u s SER 184 CO 0.02 -1.12 1.21 -2.16 0.41 0.00 0.00 173.24 171.60 1s7u s PRO 185 N -3.85 4.32 -0.38 12.44 0.04 -1.26 -4.15 135.00 142.15 1s7u s PRO 185 Ca 0.65 1.66 -0.23 0.00 0.04 0.00 0.00 61.00 63.13 1s7u s PRO 185 Cb -0.17 -3.61 0.01 0.00 0.04 0.00 0.00 34.50 30.77 1s7u s PRO 185 CO 0.33 -0.52 0.78 0.15 0.04 0.00 0.00 177.00 177.78 1s7u s LYS 186 N 2.57 3.69 0.12 4.56 1.02 -0.85 -4.89 119.74 125.95 1s7u s LYS 186 Ca 0.55 0.22 0.06 0.00 0.02 0.00 0.00 55.97 56.83 1s7u s LYS 186 Cb -0.24 -3.83 -0.04 0.00 -0.52 0.00 0.00 37.83 33.20 1s7u s LYS 186 CO 0.20 -0.89 -0.02 0.00 -0.92 0.00 0.00 175.35 173.72 1s7u s ALA 187 N 3.11 3.20 0.32 5.17 0.00 -1.26 -2.65 121.76 129.64 1s7u s ALA 187 Ca 0.31 -1.21 -0.06 0.00 0.00 0.00 0.00 51.96 51.00 1s7u s ALA 187 Cb -0.13 -1.08 0.00 0.00 0.00 0.00 0.00 23.12 21.91 1s7u s ALA 187 CO 0.18 0.63 0.48 -3.38 0.00 0.00 0.00 175.76 173.67 1s7u s HIS 188 N -1.40 0.83 -0.08 0.00 -3.43 -1.11 -5.01 115.29 105.08 1s7u s HIS 188 Ca 0.25 -1.12 -0.01 0.00 -0.80 0.00 0.00 55.06 53.38 1s7u s HIS 188 Cb -0.11 0.03 0.03 0.00 -1.43 0.00 0.00 32.58 31.10 1s7u s HIS 188 CO 0.17 -1.11 -0.02 0.08 -2.00 0.00 0.00 174.74 171.86 1s7u s VAL 189 N -3.29 0.57 0.36 -5.38 1.01 -1.26 -1.81 120.40 110.60 1s7u s VAL 189 Ca 0.28 -0.00 0.02 0.00 0.00 0.00 0.00 61.98 62.27 1s7u s VAL 189 Cb -0.00 -0.69 -0.02 0.00 0.00 0.00 0.00 36.38 35.67 1s7u s VAL 189 CO 0.16 0.29 0.55 0.42 0.00 0.00 0.00 175.10 176.53 1s7u s THR 190 N 1.89 4.66 -0.15 3.92 -4.23 -0.98 -4.86 115.64 115.89 1s7u s THR 190 Ca 0.05 -0.60 -0.01 0.00 -1.18 0.00 0.00 61.69 59.95 1s7u s THR 190 Cb -0.12 -3.69 -0.01 0.00 1.34 0.00 0.00 72.50 70.01 1s7u s THR 190 CO -0.06 -0.41 -0.12 -2.28 -0.54 0.00 0.00 174.62 171.21 1s7u s HIS 191 N -2.33 2.84 -0.29 3.99 2.46 -1.26 -3.18 115.29 117.51 1s7u s HIS 191 Ca 0.42 -0.71 -0.03 0.00 0.47 0.00 0.00 55.06 55.21 1s7u s HIS 191 Cb -0.10 -1.89 0.10 0.00 -0.13 0.00 0.00 32.58 30.57 1s7u s HIS 191 CO 0.35 -0.27 0.12 -1.01 -2.47 0.00 0.00 174.74 171.46 1s7u s HIS 192 N 0.54 0.58 -0.40 3.88 3.76 -0.99 -5.04 115.29 117.62 1s7u s HIS 192 Ca -0.08 -1.03 -0.29 0.00 -0.15 0.00 0.00 55.06 53.51 1s7u s HIS 192 Cb -0.16 -1.05 0.02 0.00 1.11 0.00 0.00 32.58 32.50 1s7u s HIS 192 CO 0.04 -0.83 1.22 -1.25 -0.85 0.00 0.00 174.74 173.06 1s7u s PRO 193 N 2.01 3.80 0.00 8.40 0.04 -1.26 -0.58 135.00 147.40 1s7u s PRO 193 Ca 0.09 0.87 0.00 0.00 0.04 0.00 0.00 61.00 62.00 1s7u s PRO 193 Cb -0.16 -3.89 0.00 0.00 0.04 0.00 0.00 34.50 30.48 1s7u s PRO 193 CO -0.34 -1.28 0.00 0.54 0.04 0.00 0.00 177.00 175.96 1s7u n ARG 194 N 7.60 0.00 -1.76 4.56 1.74 -1.00 -4.96 116.66 122.84 1s7u n ARG 194 Ca 0.13 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.90 1s7u n ARG 194 Cb 0.48 0.00 0.03 0.00 -1.02 0.00 0.00 32.46 31.95 1s7u n ARG 194 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1s7u s SER 195 N -1.00 5.68 -0.27 0.55 1.04 -1.24 -4.88 113.70 113.57 1s7u s SER 195 Ca 0.00 1.61 -0.25 0.00 0.48 0.00 0.00 55.95 57.79 1s7u s SER 195 Cb 0.00 -2.50 -0.11 0.00 0.10 0.00 0.00 66.02 63.51 1s7u s SER 195 CO 0.00 -1.24 0.97 0.29 0.98 0.00 0.00 173.24 174.24 1s7u n LYS 196 N -2.77 0.00 -2.56 4.02 5.02 -1.26 -1.87 118.16 118.75 1s7u n LYS 196 Ca 0.07 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.26 1s7u n LYS 196 Cb 0.54 -0.82 0.01 0.00 -0.02 0.00 0.00 35.03 34.74 1s7u n LYS 196 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1s7u n GLY 197 N 2.81 0.07 3.15 0.72 0.00 -1.26 -5.01 105.19 105.68 1s7u n GLY 197 Ca 0.21 -0.36 0.04 0.00 0.00 0.00 0.00 46.02 45.92 1s7u n GLY 197 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1s7u s GLU 198 N -5.00 0.45 -0.01 1.61 2.02 -0.78 -3.11 118.70 113.89 1s7u s GLU 198 Ca 0.12 0.51 -0.01 0.00 0.02 0.00 0.00 54.97 55.62 1s7u s GLU 198 Cb -0.05 0.25 -0.04 0.00 0.10 0.00 0.00 34.13 34.39 1s7u s GLU 198 CO 0.15 -0.78 0.12 0.14 0.02 0.00 0.00 175.26 174.91 1s7u s VAL 199 N 2.87 4.97 0.21 2.63 -7.23 -0.91 -2.38 120.40 120.56 1s7u s VAL 199 Ca 0.15 -0.32 -0.22 0.00 -1.81 0.00 0.00 61.98 59.78 1s7u s VAL 199 Cb -0.09 -3.29 -0.08 0.00 0.56 0.00 0.00 36.38 33.48 1s7u s VAL 199 CO -0.24 0.34 0.75 -0.89 -0.31 0.00 0.00 175.10 174.75 1s7u s THR 200 N -1.24 4.49 -0.31 5.32 2.01 0.25 -2.52 115.64 123.65 1s7u s THR 200 Ca 0.24 1.43 -0.01 0.00 0.31 0.00 0.00 61.69 63.66 1s7u s THR 200 Cb -0.12 -3.94 0.06 0.00 0.01 0.00 0.00 72.50 68.51 1s7u s THR 200 CO 0.15 0.30 0.02 -0.76 -0.69 0.00 0.00 174.62 173.64 1s7u s LEU 201 N -1.73 4.08 -0.15 4.42 1.43 -0.94 -2.34 118.68 123.44 1s7u s LEU 201 Ca 0.41 -1.43 -0.19 0.00 -1.03 0.00 0.00 54.13 51.89 1s7u s LEU 201 Cb -0.19 -1.71 -0.03 0.00 0.03 0.00 0.00 46.19 44.29 1s7u s LEU 201 CO 0.22 -0.30 0.54 -0.60 0.23 0.00 0.00 176.35 176.45 1s7u s ARG 202 N 1.21 4.28 -0.40 1.70 3.52 -1.19 -2.89 118.95 125.17 1s7u s ARG 202 Ca -0.03 0.52 -0.14 0.00 -0.13 0.00 0.00 55.73 55.94 1s7u s ARG 202 Cb -0.20 -3.50 0.02 0.00 -1.56 0.00 0.00 34.95 29.70 1s7u s ARG 202 CO -0.02 -0.03 0.28 0.00 -0.81 0.00 0.00 175.30 174.72 1s7u s TRP 204 N 1.66 3.71 -0.14 0.00 0.52 -0.75 -1.89 118.94 122.04 1s7u s TRP 204 Ca 0.05 1.09 0.01 0.00 0.02 0.00 0.00 56.10 57.27 1s7u s TRP 204 Cb -0.19 -2.37 0.02 0.00 -1.15 0.00 0.00 33.47 29.78 1s7u s TRP 204 CO 0.10 0.55 -0.17 0.00 0.02 0.00 0.00 176.95 177.45 1s7u s ALA 205 N -1.23 1.99 0.09 0.98 0.00 0.41 -2.74 121.76 121.26 1s7u s ALA 205 Ca 0.30 -0.97 0.04 0.00 0.00 0.00 0.00 51.96 51.33 1s7u s ALA 205 Cb -0.17 -1.02 -0.03 0.00 0.00 0.00 0.00 23.12 21.90 1s7u s ALA 205 CO 0.17 -0.23 -0.10 -0.51 0.00 0.00 0.00 175.76 175.09 1s7u s LEU 206 N 1.19 2.39 -1.45 0.00 1.43 -1.09 -1.64 118.68 119.52 1s7u s LEU 206 Ca -0.00 -0.78 -0.03 0.00 -1.03 0.00 0.00 54.13 52.29 1s7u s LEU 206 Cb -0.14 -0.30 0.00 0.00 0.03 0.00 0.00 46.19 45.79 1s7u s LEU 206 CO -0.07 -0.25 0.35 0.61 0.23 0.00 0.00 176.35 177.21 1s7u n GLY 207 N 0.67 -0.38 3.69 -3.19 0.00 -1.07 -2.01 105.19 102.89 1s7u n GLY 207 Ca -0.17 -0.03 -0.30 0.00 0.00 0.00 0.00 46.02 45.53 1s7u n GLY 207 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1s7u s PHE 208 N -3.04 2.99 -0.21 1.61 -0.12 -1.19 -4.43 117.98 113.59 1s7u s PHE 208 Ca 0.17 -0.03 -0.15 0.00 -0.05 0.00 0.00 56.93 56.87 1s7u s PHE 208 Cb -0.08 -1.52 0.06 0.00 -0.63 0.00 0.00 43.02 40.85 1s7u s PHE 208 CO 0.21 0.49 0.53 -0.47 -0.05 0.00 0.00 175.22 175.93 1s7u s TYR 209 N -1.37 -0.70 1.17 3.49 5.04 -0.40 -0.63 117.35 123.96 1s7u s TYR 209 Ca 0.26 1.54 -0.19 0.00 -2.44 0.00 0.00 57.07 56.24 1s7u s TYR 209 Cb -0.11 0.32 0.28 0.00 0.35 0.00 0.00 41.96 42.79 1s7u s TYR 209 CO 0.19 -0.36 1.13 -2.14 -1.34 0.00 0.00 175.55 173.03 1s7u s PRO 210 N 0.96 -1.01 0.58 4.97 0.02 -1.26 -1.65 135.00 137.60 1s7u s PRO 210 Ca -0.05 -0.09 0.37 0.00 0.02 0.00 0.00 61.00 61.24 1s7u s PRO 210 Cb -0.06 -1.62 1.66 0.00 0.02 0.00 0.00 34.50 34.50 1s7u s PRO 210 CO -0.08 -3.57 2.09 0.00 -0.33 0.00 0.00 177.00 175.11 1s7u h ALA 211 N -2.48 1.00 -2.26 -1.55 0.00 -1.95 -3.43 119.26 108.59 1s7u h ALA 211 Ca -0.45 -0.00 -0.55 0.00 0.00 0.00 0.00 54.91 53.91 1s7u h ALA 211 Cb 1.29 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1s7u h ALA 211 CO 0.35 0.00 1.18 -0.51 0.00 0.00 0.00 179.25 180.27 1s7u s ASP 212 N -5.55 6.46 0.14 0.00 1.11 -1.26 -4.95 116.67 112.62 1s7u s ASP 212 Ca -0.01 2.33 -0.18 0.00 0.18 0.00 0.00 52.55 54.87 1s7u s ASP 212 Cb 0.10 -2.53 0.05 0.00 1.07 0.00 0.00 42.92 41.61 1s7u s ASP 212 CO 0.51 -1.09 0.48 -0.51 1.18 0.00 0.00 175.17 175.74 1s7u s ILE 213 N 4.64 0.04 -0.08 0.77 2.07 -1.26 -4.67 121.20 122.72 1s7u s ILE 213 Ca 0.81 -0.41 -0.03 0.00 -1.41 0.00 0.00 60.65 59.62 1s7u s ILE 213 Cb -0.36 -1.15 0.04 0.00 0.13 0.00 0.00 42.46 41.13 1s7u s ILE 213 CO 0.35 -0.20 0.15 -0.89 -1.91 0.00 0.00 174.94 172.44 1s7u s THR 214 N -3.79 -0.21 -0.13 4.00 2.01 -0.89 -5.01 115.64 111.61 1s7u s THR 214 Ca 0.03 0.32 -0.01 0.00 0.31 0.00 0.00 61.69 62.34 1s7u s THR 214 Cb 0.01 -0.28 -0.02 0.00 0.01 0.00 0.00 72.50 72.22 1s7u s THR 214 CO -0.12 0.14 -0.08 -0.76 -0.69 0.00 0.00 174.62 173.11 1s7u s LEU 215 N 2.07 3.03 -0.03 4.42 1.02 -1.26 -1.71 118.68 126.21 1s7u s LEU 215 Ca 0.01 -0.18 0.01 0.00 0.02 0.00 0.00 54.13 53.98 1s7u s LEU 215 Cb -0.12 -1.70 0.02 0.00 0.02 0.00 0.00 46.19 44.42 1s7u s LEU 215 CO -0.06 0.21 -0.01 0.42 0.02 0.00 0.00 176.35 176.93 1s7u s THR 216 N 0.12 0.23 0.09 5.49 -4.23 -0.90 -5.00 115.64 111.44 1s7u s THR 216 Ca -0.03 0.03 -0.09 0.00 -1.18 0.00 0.00 61.69 60.42 1s7u s THR 216 Cb -0.14 -0.30 -0.06 0.00 1.34 0.00 0.00 72.50 73.34 1s7u s THR 216 CO 0.04 0.14 0.40 0.26 -0.54 0.00 0.00 174.62 174.92 1s7u s TRP 217 N 0.84 3.56 0.18 3.99 0.52 -1.26 -0.68 118.94 126.09 1s7u s TRP 217 Ca -0.09 0.75 0.07 0.00 0.02 0.00 0.00 56.10 56.85 1s7u s TRP 217 Cb -0.12 -2.13 -0.04 0.00 -1.15 0.00 0.00 33.47 30.02 1s7u s TRP 217 CO -0.01 0.50 -0.14 -0.65 0.02 0.00 0.00 176.95 176.67 1s7u s GLN 218 N -2.06 1.23 -0.63 4.98 -0.21 -0.90 -1.81 119.66 120.27 1s7u s GLN 218 Ca 0.35 -1.51 0.05 0.00 0.02 0.00 0.00 55.36 54.26 1s7u s GLN 218 Cb -0.13 -1.00 0.16 0.00 1.00 0.00 0.00 33.01 33.03 1s7u s GLN 218 CO 0.19 0.16 0.40 -1.17 -2.12 0.00 0.00 175.29 172.76 1s7u s LEU 219 N -3.14 4.51 -0.11 2.90 2.96 -1.14 -2.43 118.68 122.21 1s7u s LEU 219 Ca 0.19 -3.52 -0.00 0.00 -0.22 0.00 0.00 54.13 50.58 1s7u s LEU 219 Cb -0.01 -1.59 0.00 0.00 0.50 0.00 0.00 46.19 45.09 1s7u s LEU 219 CO 0.05 -0.14 0.00 -0.46 -1.32 0.00 0.00 176.35 174.48 1s7u n ASN 220 N 2.42 0.05 0.00 3.68 0.23 -1.11 -4.00 115.26 116.53 1s7u n ASN 220 Ca 0.15 -0.09 0.00 0.00 -0.53 0.00 0.00 54.58 54.10 1s7u n ASN 220 Cb 0.34 -0.12 0.00 0.00 -2.08 0.00 0.00 39.78 37.93 1s7u n ASN 220 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1s7u n GLY 221 N -1.11 -2.17 3.57 4.83 0.00 -1.26 -5.17 105.19 103.88 1s7u n GLY 221 Ca -0.02 0.71 -0.24 0.00 0.00 0.00 0.00 46.02 46.47 1s7u n GLY 221 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1s7u s GLU 222 N 0.00 2.03 1.05 1.61 1.03 -1.26 -5.07 118.70 118.10 1s7u s GLU 222 Ca 0.00 -1.50 -0.13 0.00 0.03 0.00 0.00 54.97 53.37 1s7u s GLU 222 Cb 0.00 -2.03 0.22 0.00 -0.80 0.00 0.00 34.13 31.52 1s7u s GLU 222 CO 0.00 0.37 1.07 -1.21 -1.33 0.00 0.00 175.26 174.16 1s7u s GLU 223 N -3.44 -0.02 -0.20 -4.83 2.02 -1.26 -2.90 118.70 108.07 1s7u s GLU 223 Ca 0.29 0.58 -0.02 0.00 0.02 0.00 0.00 54.97 55.85 1s7u s GLU 223 Cb -0.06 -1.68 0.06 0.00 0.10 0.00 0.00 34.13 32.55 1s7u s GLU 223 CO 0.17 -3.05 0.01 -0.51 0.02 0.00 0.00 175.26 171.89 1s7u s LEU 224 N -6.69 1.55 -0.09 1.80 1.02 -0.75 -4.86 118.68 110.65 1s7u s LEU 224 Ca 0.66 -0.89 0.15 0.00 0.02 0.00 0.00 54.13 54.08 1s7u s LEU 224 Cb -0.20 -0.76 0.53 0.00 0.02 0.00 0.00 46.19 45.77 1s7u s LEU 224 CO 0.60 -0.28 1.44 0.41 0.02 0.00 0.00 176.35 178.54 1s7u n THR 225 N 4.95 1.65 -2.37 5.49 -1.04 -1.26 -4.65 114.28 117.05 1s7u n THR 225 Ca -0.10 -1.31 -0.40 0.00 -2.04 0.00 0.00 64.05 60.20 1s7u n THR 225 Cb 0.46 0.16 -0.01 0.00 -1.82 0.00 0.00 70.33 69.12 1s7u n THR 225 CO 0.00 0.00 0.00 1.67 -0.64 0.00 0.00 175.07 176.10 1s7u n GLN 226 N 0.49 2.79 -3.76 -2.82 7.27 -1.26 -4.18 117.38 115.91 1s7u n GLN 226 Ca 0.20 -3.02 -0.24 0.00 0.07 0.00 0.00 57.00 54.01 1s7u n GLN 226 Cb 0.73 -3.52 0.02 0.00 2.41 0.00 0.00 30.24 29.88 1s7u n GLN 226 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 1s7u n ASP 227 N 9.47 -1.67 -4.68 1.69 10.43 -1.26 -4.88 116.55 125.65 1s7u n ASP 227 Ca 0.48 -0.90 -0.43 0.00 2.57 0.00 0.00 54.79 56.52 1s7u n ASP 227 Cb 0.45 -3.69 -0.02 0.00 1.84 0.00 0.00 41.12 39.70 1s7u n ASP 227 CO 0.00 0.00 0.00 -0.32 -1.07 0.00 0.00 177.20 175.81 1s7u s MET 228 N -6.10 4.36 0.36 -1.24 1.75 -1.26 -4.75 119.30 112.43 1s7u s MET 228 Ca 0.09 1.46 -0.12 0.00 -1.25 0.00 0.00 55.69 55.86 1s7u s MET 228 Cb -0.03 -3.58 -0.07 0.00 2.84 0.00 0.00 34.83 33.99 1s7u s MET 228 CO 0.84 -0.43 0.74 -1.21 -0.65 0.00 0.00 175.02 174.31 1s7u s GLU 229 N 2.38 3.86 0.21 4.11 0.41 -0.69 -4.95 118.70 124.04 1s7u s GLU 229 Ca 0.49 0.52 -0.22 0.00 -0.41 0.00 0.00 54.97 55.35 1s7u s GLU 229 Cb -0.19 -2.42 0.06 0.00 -1.78 0.00 0.00 34.13 29.80 1s7u s GLU 229 CO 0.16 0.06 0.93 -0.48 -0.49 0.00 0.00 175.26 175.44 1s7u s LEU 230 N -3.48 -0.10 0.23 1.80 0.05 -1.26 -1.60 118.68 114.33 1s7u s LEU 230 Ca 0.52 -0.63 0.11 0.00 0.05 0.00 0.00 54.13 54.18 1s7u s LEU 230 Cb -0.10 2.31 -0.05 0.00 -2.05 0.00 0.00 46.19 46.30 1s7u s LEU 230 CO 0.26 -1.10 -0.20 0.68 -0.55 0.00 0.00 176.35 175.43 1s7u s VAL 231 N -2.84 2.53 0.26 1.48 -7.23 -1.13 -5.01 120.40 108.46 1s7u s VAL 231 Ca 0.16 -2.14 -0.31 0.00 -1.81 0.00 0.00 61.98 57.88 1s7u s VAL 231 Cb -0.03 -2.27 -0.12 0.00 0.56 0.00 0.00 36.38 34.53 1s7u s VAL 231 CO 0.05 -0.24 1.66 1.21 -0.31 0.00 0.00 175.10 177.47 1s7u n GLU 232 N -0.16 2.74 -1.65 4.82 2.13 -1.26 -4.68 120.64 122.59 1s7u n GLU 232 Ca -0.09 0.98 -0.44 0.00 0.66 0.00 0.00 57.16 58.27 1s7u n GLU 232 Cb 0.58 -2.79 -0.02 0.00 0.27 0.00 0.00 31.44 29.47 1s7u n GLU 232 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 1s7u n THR 233 N 2.95 1.58 -3.90 6.31 -1.04 -1.26 -4.91 114.28 114.01 1s7u n THR 233 Ca 0.12 -0.40 -0.11 0.00 -2.04 0.00 0.00 64.05 61.62 1s7u n THR 233 Cb 0.36 -1.33 -0.13 0.00 -1.82 0.00 0.00 70.33 67.41 1s7u n THR 233 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1s7u s ARG 234 N -1.22 0.08 0.04 -2.82 1.70 -0.80 -4.99 118.95 110.95 1s7u s ARG 234 Ca 0.62 -0.15 -0.30 0.00 -0.47 0.00 0.00 55.73 55.42 1s7u s ARG 234 Cb -0.65 0.03 -0.05 0.00 -0.57 0.00 0.00 34.95 33.71 1s7u s ARG 234 CO 0.57 -0.01 1.09 -1.25 -1.08 0.00 0.00 175.30 174.62 1s7u s PRO 235 N -0.36 4.50 0.57 3.89 0.04 -1.26 -0.60 135.00 141.77 1s7u s PRO 235 Ca -0.04 1.61 0.31 0.00 0.04 0.00 0.00 61.00 62.92 1s7u s PRO 235 Cb -0.03 -3.39 1.73 0.00 0.04 0.00 0.00 34.50 32.85 1s7u s PRO 235 CO -0.00 -0.14 2.18 0.00 0.04 0.00 0.00 177.00 179.08 1s7u h ALA 236 N 6.67 1.32 0.00 8.56 0.00 -1.63 -3.47 119.26 130.72 1s7u h ALA 236 Ca -0.42 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1s7u h ALA 236 Cb 1.22 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1s7u h ALA 236 CO 0.78 0.07 0.00 0.41 0.00 0.00 0.00 179.25 180.50 1s7u n GLY 237 N -0.95 0.64 1.20 0.00 0.00 -1.26 -4.94 105.19 99.88 1s7u n GLY 237 Ca -0.02 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.99 1s7u n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1s7u n ASP 238 N 0.00 3.38 0.00 1.61 5.75 -1.26 -4.95 116.55 121.08 1s7u n ASP 238 Ca 0.00 -3.39 0.00 0.00 -0.01 0.00 0.00 54.79 51.39 1s7u n ASP 238 Cb 0.00 -0.62 0.00 0.00 -1.03 0.00 0.00 41.12 39.47 1s7u n ASP 238 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1s7u n GLY 239 N -0.78 3.03 4.01 6.12 0.00 -1.26 -5.04 105.19 111.28 1s7u n GLY 239 Ca 0.31 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.12 1s7u n GLY 239 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1s7u s THR 240 N -1.74 2.35 0.21 2.61 -4.23 -1.26 -4.87 115.64 108.71 1s7u s THR 240 Ca 0.00 -0.85 0.08 0.00 -1.18 0.00 0.00 61.69 59.74 1s7u s THR 240 Cb 0.00 -2.51 -0.05 0.00 1.34 0.00 0.00 72.50 71.28 1s7u s THR 240 CO 0.00 0.00 -0.13 -0.36 -0.54 0.00 0.00 174.62 173.59 1s7u s PHE 241 N -2.76 1.74 0.06 3.99 0.08 0.19 -1.65 117.98 119.64 1s7u s PHE 241 Ca 0.61 -0.59 0.06 0.00 0.12 0.00 0.00 56.93 57.14 1s7u s PHE 241 Cb -0.07 -0.83 -0.03 0.00 -0.57 0.00 0.00 43.02 41.52 1s7u s PHE 241 CO 0.39 0.35 -0.18 -0.65 -0.10 0.00 0.00 175.22 175.04 1s7u s GLN 242 N -3.66 1.08 0.02 0.44 -0.21 0.23 -2.60 119.66 114.96 1s7u s GLN 242 Ca 0.23 -0.95 -0.27 0.00 0.02 0.00 0.00 55.36 54.40 1s7u s GLN 242 Cb -0.00 -1.18 0.07 0.00 1.00 0.00 0.00 33.01 32.89 1s7u s GLN 242 CO 0.07 0.29 0.62 0.21 -2.12 0.00 0.00 175.29 174.36 1s7u s LYS 243 N -1.46 1.10 0.14 2.91 2.20 -0.65 -1.90 119.74 122.08 1s7u s LYS 243 Ca 0.04 -0.02 -0.06 0.00 -0.36 0.00 0.00 55.97 55.57 1s7u s LYS 243 Cb -0.09 0.51 -0.02 0.00 -1.51 0.00 0.00 37.83 36.72 1s7u s LYS 243 CO 0.02 -0.39 0.18 1.67 -0.36 0.00 0.00 175.35 176.48 1s7u s TRP 244 N -2.03 0.54 -0.28 4.03 1.48 -1.26 -0.45 118.94 120.97 1s7u s TRP 244 Ca -0.07 -0.92 -0.11 0.00 -1.06 0.00 0.00 56.10 53.94 1s7u s TRP 244 Cb -0.01 -0.22 0.12 0.00 -1.16 0.00 0.00 33.47 32.21 1s7u s TRP 244 CO 0.02 -0.62 0.62 0.00 -4.06 0.00 0.00 176.95 172.92 1s7u s ALA 245 N -3.98 -1.90 0.23 2.67 0.00 -0.79 -2.82 121.76 115.17 1s7u s ALA 245 Ca 0.18 2.25 0.09 0.00 0.00 0.00 0.00 51.96 54.47 1s7u s ALA 245 Cb 0.05 -1.66 -0.05 0.00 0.00 0.00 0.00 23.12 21.47 1s7u s ALA 245 CO -0.01 -0.81 -0.15 -1.54 0.00 0.00 0.00 175.76 173.25 1s7u s SER 246 N 2.65 2.82 0.18 0.00 1.04 -0.63 -1.42 113.70 118.34 1s7u s SER 246 Ca -0.06 -1.04 0.02 0.00 0.48 0.00 0.00 55.95 55.35 1s7u s SER 246 Cb -0.11 -0.18 -0.05 0.00 0.10 0.00 0.00 66.02 65.79 1s7u s SER 246 CO -0.18 -0.14 0.01 0.68 0.98 0.00 0.00 173.24 174.59 1s7u s VAL 247 N -2.87 0.62 -0.11 5.02 -7.23 -1.14 -1.70 120.40 113.00 1s7u s VAL 247 Ca 0.25 -1.98 -0.16 0.00 -1.81 0.00 0.00 61.98 58.28 1s7u s VAL 247 Cb -0.01 -2.15 -0.05 0.00 0.56 0.00 0.00 36.38 34.73 1s7u s VAL 247 CO 0.09 -0.44 0.41 0.68 -0.31 0.00 0.00 175.10 175.53 1s7u s VAL 248 N -3.70 5.20 -0.08 1.32 -7.23 -1.26 -2.21 120.40 112.44 1s7u s VAL 248 Ca 0.25 0.81 -0.04 0.00 -1.81 0.00 0.00 61.98 61.19 1s7u s VAL 248 Cb 0.06 -3.74 0.04 0.00 0.56 0.00 0.00 36.38 33.29 1s7u s VAL 248 CO 0.04 0.39 0.18 -0.69 -0.31 0.00 0.00 175.10 174.72 1s7u s VAL 249 N 0.28 -0.03 0.41 1.32 1.01 -1.05 -5.02 120.40 117.31 1s7u s VAL 249 Ca 0.23 0.13 -0.26 0.00 0.00 0.00 0.00 61.98 62.08 1s7u s VAL 249 Cb -0.15 -0.29 -0.10 0.00 0.00 0.00 0.00 36.38 35.84 1s7u s VAL 249 CO 0.09 0.05 1.23 -2.65 0.00 0.00 0.00 175.10 173.82 1s7u n PRO 250 N 3.92 1.87 -2.41 2.72 -0.02 -1.26 -2.14 135.00 137.68 1s7u n PRO 250 Ca -0.23 0.66 -0.41 0.00 -2.02 0.00 0.00 63.50 61.51 1s7u n PRO 250 Cb 0.54 -2.32 -0.04 0.00 -0.02 0.00 0.00 33.50 31.66 1s7u n PRO 250 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1s7u s LEU 251 N -1.39 4.47 0.00 2.45 0.20 -1.18 -2.54 118.68 120.68 1s7u s LEU 251 Ca 0.60 2.22 0.00 0.00 0.69 0.00 0.00 54.13 57.64 1s7u s LEU 251 Cb -0.53 -3.61 0.00 0.00 -0.43 0.00 0.00 46.19 41.62 1s7u s LEU 251 CO 0.58 -0.32 0.00 0.61 -0.29 0.00 0.00 176.35 176.94 1s7u n GLY 252 N 2.01 3.16 2.87 7.98 0.00 -1.26 -4.92 105.19 115.01 1s7u n GLY 252 Ca 0.03 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 1s7u n GLY 252 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1s7u n LYS 253 N -1.23 3.14 -0.00 1.61 4.76 -1.05 -4.76 118.16 120.62 1s7u n LYS 253 Ca 0.00 -4.76 0.06 0.00 -2.87 0.00 0.00 58.31 50.75 1s7u n LYS 253 Cb 0.00 -2.21 -0.08 0.00 -1.84 0.00 0.00 35.03 30.90 1s7u n LYS 253 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 1s7u n GLU 254 N -0.24 1.95 0.00 1.97 0.00 -1.26 -4.36 120.64 118.71 1s7u n GLU 254 Ca 0.31 -0.04 0.14 0.00 0.00 0.00 0.00 57.16 57.58 1s7u n GLU 254 Cb 0.43 -1.19 0.71 0.00 0.00 0.00 0.00 31.44 31.39 1s7u n GLU 254 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 1s7u n GLN 255 N -1.51 0.30 0.14 3.44 1.13 -1.26 -3.01 117.38 116.61 1s7u n GLN 255 Ca 0.01 0.00 -0.01 0.00 -1.94 0.00 0.00 57.00 55.07 1s7u n GLN 255 Cb 0.25 -1.50 0.24 0.00 0.11 0.00 0.00 30.24 29.34 1s7u n GLN 255 CO 0.00 0.00 0.00 -0.91 -1.44 0.00 0.00 177.06 174.71 1s7u h ASN 256 N 0.00 0.09 -2.97 1.08 4.21 -1.96 -3.46 115.58 112.58 1s7u h ASN 256 Ca 0.00 -0.04 -0.62 0.00 1.21 0.00 0.00 56.30 56.85 1s7u h ASN 256 Cb 0.34 -0.03 -0.06 0.00 -1.12 0.00 0.00 38.32 37.46 1s7u h ASN 256 CO 0.00 0.57 -0.24 -0.31 -1.29 0.00 0.00 177.43 176.16 1s7u s TYR 257 N -3.95 3.71 -0.21 1.19 1.51 -1.16 -2.74 117.35 115.69 1s7u s TYR 257 Ca -0.03 0.93 -0.03 0.00 -1.01 0.00 0.00 57.07 56.92 1s7u s TYR 257 Cb 0.13 -2.24 0.07 0.00 -0.11 0.00 0.00 41.96 39.82 1s7u s TYR 257 CO 0.76 0.65 0.07 0.95 -1.11 0.00 0.00 175.55 176.87 1s7u s THR 258 N -1.08 0.29 0.54 -0.71 -4.23 -1.02 -4.64 115.64 104.79 1s7u s THR 258 Ca 0.23 -0.57 -0.20 0.00 -1.18 0.00 0.00 61.69 59.97 1s7u s THR 258 Cb -0.16 -0.96 -0.05 0.00 1.34 0.00 0.00 72.50 72.67 1s7u s THR 258 CO 0.12 -0.36 1.19 0.00 -0.54 0.00 0.00 174.62 175.03 1s7u s ARG 260 N -3.12 0.64 -0.17 0.00 0.52 0.14 -2.13 118.95 114.83 1s7u s ARG 260 Ca 0.72 -0.07 -0.04 0.00 -0.52 0.00 0.00 55.73 55.83 1s7u s ARG 260 Cb -0.29 -0.69 -0.02 0.00 0.52 0.00 0.00 34.95 34.47 1s7u s ARG 260 CO 0.33 -0.07 -0.03 0.08 0.02 0.00 0.00 175.30 175.63 1s7u s VAL 261 N 0.81 3.80 -0.23 3.52 1.01 -0.89 -2.12 120.40 126.30 1s7u s VAL 261 Ca -0.10 -0.38 -0.00 0.00 0.00 0.00 0.00 61.98 61.50 1s7u s VAL 261 Cb -0.13 -2.68 0.03 0.00 0.00 0.00 0.00 36.38 33.60 1s7u s VAL 261 CO -0.00 0.47 -0.11 -0.31 0.00 0.00 0.00 175.10 175.15 1s7u s TYR 262 N 0.63 3.00 -0.11 5.22 1.51 -0.69 -2.62 117.35 124.29 1s7u s TYR 262 Ca -0.02 -1.65 -0.22 0.00 -1.01 0.00 0.00 57.07 54.17 1s7u s TYR 262 Cb -0.14 -2.00 0.05 0.00 -0.11 0.00 0.00 41.96 39.76 1s7u s TYR 262 CO 0.02 -0.76 0.53 -1.58 -1.11 0.00 0.00 175.55 172.65 1s7u s HIS 263 N 1.29 -0.52 0.39 2.71 2.46 -1.26 -2.10 115.29 118.26 1s7u s HIS 263 Ca 0.01 1.08 0.24 0.00 0.47 0.00 0.00 55.06 56.86 1s7u s HIS 263 Cb -0.16 0.24 1.28 0.00 -0.13 0.00 0.00 32.58 33.81 1s7u s HIS 263 CO -0.07 -0.41 2.02 1.05 -2.47 0.00 0.00 174.74 174.86 1s7u h GLU 264 N 4.26 0.00 0.00 2.88 4.11 -1.95 -2.71 114.58 121.18 1s7u h GLU 264 Ca -0.28 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 59.07 1s7u h GLU 264 Cb 1.16 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.40 1s7u h GLU 264 CO 0.28 0.16 -0.36 0.78 0.07 0.00 0.00 179.01 179.94 1s7u h GLY 265 N 0.94 0.00 -4.16 1.06 0.00 -1.87 -3.45 103.07 95.60 1s7u h GLY 265 Ca -0.00 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.80 1s7u h GLY 265 CO 0.02 0.00 0.76 1.08 0.00 0.00 0.00 176.54 178.40 1s7u s LEU 266 N -6.66 4.38 0.33 3.11 1.02 -1.02 -4.74 118.68 115.09 1s7u s LEU 266 Ca 0.02 2.74 0.03 0.00 0.02 0.00 0.00 54.13 56.95 1s7u s LEU 266 Cb 0.09 -3.63 0.56 0.00 0.02 0.00 0.00 46.19 43.23 1s7u s LEU 266 CO 0.70 -0.71 1.86 1.55 0.02 0.00 0.00 176.35 179.76 1s7u h PRO 267 N 4.54 0.57 -3.23 1.29 0.13 -1.88 -3.45 132.00 129.96 1s7u h PRO 267 Ca -0.47 -0.12 -0.06 0.00 -0.87 0.00 0.00 66.00 64.48 1s7u h PRO 267 Cb 1.22 -0.08 -0.14 0.00 0.13 0.00 0.00 31.00 32.13 1s7u h PRO 267 CO 0.74 0.59 -0.07 -1.83 -0.23 0.00 0.00 178.00 177.20 1s7u s GLU 268 N -4.99 1.02 0.13 0.86 -1.05 -1.26 -5.14 118.70 108.28 1s7u s GLU 268 Ca -0.08 -0.56 -0.34 0.00 -0.15 0.00 0.00 54.97 53.84 1s7u s GLU 268 Cb 0.15 0.45 -0.14 0.00 -0.44 0.00 0.00 34.13 34.16 1s7u s GLU 268 CO 0.77 -0.38 1.58 -2.30 0.95 0.00 0.00 175.26 175.88 1s7u n PRO 269 N 0.05 2.07 -2.37 -4.83 -0.02 -1.26 -4.94 135.00 123.70 1s7u n PRO 269 Ca -0.17 0.75 -0.40 0.00 -2.02 0.00 0.00 63.50 61.66 1s7u n PRO 269 Cb 0.62 -2.51 -0.03 0.00 -0.02 0.00 0.00 33.50 31.56 1s7u n PRO 269 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1s7u s LEU 270 N 1.13 4.47 -0.09 2.45 1.43 -1.08 -4.86 118.68 122.14 1s7u s LEU 270 Ca 0.80 2.38 0.04 0.00 -1.03 0.00 0.00 54.13 56.32 1s7u s LEU 270 Cb -0.70 -3.70 -0.01 0.00 0.03 0.00 0.00 46.19 41.81 1s7u s LEU 270 CO 0.40 -0.31 -0.22 -0.89 0.23 0.00 0.00 176.35 175.55 1s7u s THR 271 N -1.20 2.24 -0.05 5.49 2.01 -1.26 -2.10 115.64 120.76 1s7u s THR 271 Ca 0.47 -0.98 -0.18 0.00 0.31 0.00 0.00 61.69 61.32 1s7u s THR 271 Cb -0.33 -1.85 0.04 0.00 0.01 0.00 0.00 72.50 70.36 1s7u s THR 271 CO 0.43 0.56 0.41 -0.76 -0.69 0.00 0.00 174.62 174.57 1s7u s LEU 272 N 0.11 0.45 0.00 4.42 1.43 -0.91 -5.02 118.68 119.16 1s7u s LEU 272 Ca -0.11 0.35 -0.01 0.00 -1.03 0.00 0.00 54.13 53.34 1s7u s LEU 272 Cb -0.16 1.57 0.00 0.00 0.03 0.00 0.00 46.19 47.64 1s7u s LEU 272 CO 0.06 -0.43 0.21 -2.11 0.23 0.00 0.00 176.35 174.31 1s7u n ARG 273 N 1.46 0.31 0.00 1.70 0.00 -1.26 -1.41 116.66 117.46 1s7u n ARG 273 Ca -0.20 -1.27 0.04 0.00 -0.00 0.00 0.00 57.85 56.43 1s7u n ARG 273 Cb 0.56 1.21 0.23 0.00 -0.00 0.00 0.00 32.46 34.46 1s7u n ARG 273 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.63 179.50